NP-MRD: Showing NP-Card for alstiphyllanine C (NP0034227)

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Record Information

Version

1.0

Created at

2021-06-20 18:01:02 UTC

Updated at

2021-06-30 00:04:28 UTC

NP-MRD ID

NP0034227

Secondary Accession Numbers

None

Natural Product Identification

Common Name

alstiphyllanine C

Provided By

JEOL Database JEOL Logo

Description

alstiphyllanine C is found in Alstonia macrophylla. It was first documented in 2009 (Hirasawa, Y., et al.).

Structure

MOL 3D MOL SDF 3D SDF PDB SMILES InChI


  Mrv1652306202120013D          

 86 92  0  0  0  0            999 V2000
   -3.3491    1.0736    2.6474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2969   -0.3968    2.3657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6091   -1.0564    1.4077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8653   -2.5353    1.2526 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8435   -3.3123    0.4649 N   0  3  2  0  0  4  0  0  0  0  0  0
   -2.4901   -4.5998   -0.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5942   -3.7094    1.2508 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0081   -2.5525    2.0444 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5216   -1.6103    0.9318 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0297   -1.5151    0.8325 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9382   -1.0781    1.7855 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2914   -1.0140    1.4446 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1042   -0.5661    2.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4932   -0.4610    2.1592 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7046   -1.3869    0.1571 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7785   -1.8351   -0.7966 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4413   -1.9109   -0.4538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3620   -2.3357   -1.2476 N   0  0  1  0  0  0  0  0  0  0  0  0
    1.5901   -3.1847   -2.3968 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3004   -2.5576   -0.2968 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4053   -3.8977    0.2616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1758   -2.5511   -0.7441 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8024   -1.1815   -0.9218 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.7056   -0.3794    0.3841 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1934   -0.2012    0.7825 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5288    0.6887   -0.3034 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3076    1.7919   -0.7031 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2515    2.6372   -1.6049 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3306    2.4774   -2.1496 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6500    3.7899   -1.8666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3035    4.6806   -2.8921 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1128    5.7851   -3.1707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8598    6.7065   -4.1542 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2917    6.5132   -4.9655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2763    5.9987   -2.4033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0588    7.0979   -2.6646 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5317    8.2477   -1.9987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6527    5.0852   -1.4082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7635    5.1501   -0.6083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9404    5.6748   -1.2175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8179    4.0016   -1.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0641    0.5590    2.1184 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1152    0.0137    3.2003 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2011    1.9021    1.9725 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0137    2.6654    3.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9181    1.2772    3.6317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8303    1.6813    1.9052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3933    1.4028    2.6616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9470   -0.9654    3.0347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8173   -2.6442    0.7160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9699   -3.0376    2.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2900   -4.3282   -0.7391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8951   -5.1436    0.8150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7352   -5.2044   -0.5560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7832   -4.6080    1.8472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7034   -2.1303    2.7525 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8483   -2.9299    2.6418 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6212   -0.7802    2.7813 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9210   -1.4401    1.9198 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9948   -0.0889    3.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6745    0.2586    1.3540 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7485   -1.3389   -0.1383 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1287   -2.1121   -1.7853 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0401   -4.1390   -2.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2439   -2.6942   -3.1255 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6473   -3.3987   -2.9096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3255   -3.1686   -1.6369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8521   -1.2869   -1.2277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3113   -0.6544   -1.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1445    0.6029    0.1758 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4728    1.0912    0.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7373    0.1189   -1.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063    4.4928   -3.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2312    5.5702   -5.5187 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2075    6.5646   -4.3676 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3256    7.3265   -5.6967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5648    8.5469   -2.4158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4435    8.0762   -0.9199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2343    9.0722   -2.1526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0428    5.3664   -2.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7997    5.2719   -0.6722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9723    6.7630   -1.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1004    3.3271   -0.3210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1172    3.7220    2.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7166    2.3957    3.9320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0343    2.5173    3.5299 H   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  1  0  0  0  0
 26 25  1  0  0  0  0
  5 22  1  0  0  0  0
 22 67  1  6  0  0  0
 17 16  2  0  0  0  0
 26 27  1  0  0  0  0
 12 11  1  0  0  0  0
 27 28  1  0  0  0  0
 11 10  2  0  0  0  0
 28 29  2  0  0  0  0
  9 20  1  0  0  0  0
 28 30  1  0  0  0  0
 10 17  1  0  0  0  0
 25 42  1  1  0  0  0
 16 15  1  0  0  0  0
 42 44  1  0  0  0  0
  5  4  1  0  0  0  0
 42 43  2  0  0  0  0
 22 23  1  0  0  0  0
 44 45  1  0  0  0  0
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 13 14  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  6  0  0  0
  9 25  1  6  0  0  0
 20 21  1  0  0  0  0
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  3  2  2  0  0  0  0
 30 31  2  0  0  0  0
 15 12  2  0  0  0  0
 31 32  1  0  0  0  0
  2  1  1  0  0  0  0
 32 35  2  0  0  0  0
 10  9  1  0  0  0  0
 35 38  1  0  0  0  0
  9  8  1  0  0  0  0
 38 41  2  0  0  0  0
 41 30  1  0  0  0  0
 17 18  1  0  0  0  0
 32 33  1  0  0  0  0
 20 18  1  6  0  0  0
 35 36  1  0  0  0  0
 20 22  1  0  0  0  0
 33 34  1  0  0  0  0
 18 19  1  0  0  0  0
 36 37  1  0  0  0  0
  5  7  1  0  0  0  0
 38 39  1  0  0  0  0
  7  8  1  0  0  0  0
 39 40  1  0  0  0  0
 16 63  1  0  0  0  0
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 11 58  1  0  0  0  0
  7 55  1  1  0  0  0
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 23 68  1  0  0  0  0
 23 69  1  0  0  0  0
 24 70  1  6  0  0  0
  4 50  1  0  0  0  0
  4 51  1  0  0  0  0
  2 49  1  0  0  0  0
  1 46  1  0  0  0  0
  1 47  1  0  0  0  0
  1 48  1  0  0  0  0
 19 64  1  0  0  0  0
 19 65  1  0  0  0  0
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 26 71  1  0  0  0  0
 26 72  1  0  0  0  0
 45 84  1  0  0  0  0
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 31 73  1  0  0  0  0
 41 83  1  0  0  0  0
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 40 80  1  0  0  0  0
 40 81  1  0  0  0  0
 40 82  1  0  0  0  0
M  CHG  1   5   1
M  END

     RDKit          3D

 86 92  0  0  0  0  0  0  0  0999 V2000
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   -2.8653   -2.5353    1.2526 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5942   -3.7094    1.2508 C   0  0  2  0  0  0  0  0  0  0  0  0
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    2.0401   -4.1390   -2.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2439   -2.6942   -3.1255 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6473   -3.3987   -2.9096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3255   -3.1686   -1.6369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8521   -1.2869   -1.2277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3113   -0.6544   -1.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1445    0.6029    0.1758 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4728    1.0912    0.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7373    0.1189   -1.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063    4.4928   -3.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2312    5.5702   -5.5187 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2075    6.5646   -4.3676 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3256    7.3265   -5.6967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5648    8.5469   -2.4158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4435    8.0762   -0.9199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2343    9.0722   -2.1526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0428    5.3664   -2.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7997    5.2719   -0.6722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9723    6.7630   -1.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1004    3.3271   -0.3210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1172    3.7220    2.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7166    2.3957    3.9320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0343    2.5173    3.5299 H   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  1  0
 26 25  1  0
  5 22  1  0
 22 67  1  6
 17 16  2  0
 26 27  1  0
 12 11  1  0
 27 28  1  0
 11 10  2  0
 28 29  2  0
  9 20  1  0
 28 30  1  0
 10 17  1  0
 25 42  1  1
 16 15  1  0
 42 44  1  0
  5  4  1  0
 42 43  2  0
 22 23  1  0
 44 45  1  0
 23 24  1  0
 12 13  1  0
 24  3  1  0
 13 14  1  0
  3  4  1  0
  5  6  1  6
  9 25  1  6
 20 21  1  0
  7 21  1  0
  3  2  2  0
 30 31  2  0
 15 12  2  0
 31 32  1  0
  2  1  1  0
 32 35  2  0
 10  9  1  0
 35 38  1  0
  9  8  1  0
 38 41  2  0
 41 30  1  0
 17 18  1  0
 32 33  1  0
 20 18  1  6
 35 36  1  0
 20 22  1  0
 33 34  1  0
 18 19  1  0
 36 37  1  0
  5  7  1  0
 38 39  1  0
  7  8  1  0
 39 40  1  0
 16 63  1  0
 15 62  1  0
 11 58  1  0
  7 55  1  1
  8 56  1  0
  8 57  1  0
 23 68  1  0
 23 69  1  0
 24 70  1  6
  4 50  1  0
  4 51  1  0
  2 49  1  0
  1 46  1  0
  1 47  1  0
  1 48  1  0
 19 64  1  0
 19 65  1  0
 19 66  1  0
 26 71  1  0
 26 72  1  0
 45 84  1  0
 45 85  1  0
 45 86  1  0
 14 59  1  0
 14 60  1  0
 14 61  1  0
  6 52  1  0
  6 53  1  0
  6 54  1  0
 31 73  1  0
 41 83  1  0
 34 74  1  0
 34 75  1  0
 34 76  1  0
 37 77  1  0
 37 78  1  0
 37 79  1  0
 40 80  1  0
 40 81  1  0
 40 82  1  0
M  CHG  1   5   1
M  END


  Mrv1652306202120013D          

 86 92  0  0  0  0            999 V2000
   -3.3491    1.0736    2.6474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2969   -0.3968    2.3657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6091   -1.0564    1.4077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8653   -2.5353    1.2526 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8435   -3.3123    0.4649 N   0  3  2  0  0  4  0  0  0  0  0  0
   -2.4901   -4.5998   -0.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5942   -3.7094    1.2508 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0081   -2.5525    2.0444 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5216   -1.6103    0.9318 C   0  0  1  0  0  0  0  0  0  0  0  0
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    2.9382   -1.0781    1.7855 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2914   -1.0140    1.4446 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1042   -0.5661    2.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4932   -0.4610    2.1592 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7046   -1.3869    0.1571 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3306    2.4774   -2.1496 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6500    3.7899   -1.8666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3035    4.6806   -2.8921 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1128    5.7851   -3.1707 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2917    6.5132   -4.9655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2763    5.9987   -2.4033 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5317    8.2477   -1.9987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6527    5.0852   -1.4082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7635    5.1501   -0.6083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9404    5.6748   -1.2175 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0641    0.5590    2.1184 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1152    0.0137    3.2003 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2011    1.9021    1.9725 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6473   -3.3987   -2.9096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3255   -3.1686   -1.6369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8521   -1.2869   -1.2277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3113   -0.6544   -1.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1445    0.6029    0.1758 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4728    1.0912    0.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7373    0.1189   -1.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063    4.4928   -3.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2312    5.5702   -5.5187 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2075    6.5646   -4.3676 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3256    7.3265   -5.6967 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.0428    5.3664   -2.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1004    3.3271   -0.3210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1172    3.7220    2.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7166    2.3957    3.9320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0343    2.5173    3.5299 H   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  1  0  0  0  0
 26 25  1  0  0  0  0
  5 22  1  0  0  0  0
 22 67  1  6  0  0  0
 17 16  2  0  0  0  0
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 11 10  2  0  0  0  0
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 16 15  1  0  0  0  0
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  5  4  1  0  0  0  0
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 24  3  1  0  0  0  0
 13 14  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  6  0  0  0
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 20 21  1  0  0  0  0
  7 21  1  0  0  0  0
  3  2  2  0  0  0  0
 30 31  2  0  0  0  0
 15 12  2  0  0  0  0
 31 32  1  0  0  0  0
  2  1  1  0  0  0  0
 32 35  2  0  0  0  0
 10  9  1  0  0  0  0
 35 38  1  0  0  0  0
  9  8  1  0  0  0  0
 38 41  2  0  0  0  0
 41 30  1  0  0  0  0
 17 18  1  0  0  0  0
 32 33  1  0  0  0  0
 20 18  1  6  0  0  0
 35 36  1  0  0  0  0
 20 22  1  0  0  0  0
 33 34  1  0  0  0  0
 18 19  1  0  0  0  0
 36 37  1  0  0  0  0
  5  7  1  0  0  0  0
 38 39  1  0  0  0  0
  7  8  1  0  0  0  0
 39 40  1  0  0  0  0
 16 63  1  0  0  0  0
 15 62  1  0  0  0  0
 11 58  1  0  0  0  0
  7 55  1  1  0  0  0
  8 56  1  0  0  0  0
  8 57  1  0  0  0  0
 23 68  1  0  0  0  0
 23 69  1  0  0  0  0
 24 70  1  6  0  0  0
  4 50  1  0  0  0  0
  4 51  1  0  0  0  0
  2 49  1  0  0  0  0
  1 46  1  0  0  0  0
  1 47  1  0  0  0  0
  1 48  1  0  0  0  0
 19 64  1  0  0  0  0
 19 65  1  0  0  0  0
 19 66  1  0  0  0  0
 26 71  1  0  0  0  0
 26 72  1  0  0  0  0
 45 84  1  0  0  0  0
 45 85  1  0  0  0  0
 45 86  1  0  0  0  0
 14 59  1  0  0  0  0
 14 60  1  0  0  0  0
 14 61  1  0  0  0  0
  6 52  1  0  0  0  0
  6 53  1  0  0  0  0
  6 54  1  0  0  0  0
 31 73  1  0  0  0  0
 41 83  1  0  0  0  0
 34 74  1  0  0  0  0
 34 75  1  0  0  0  0
 34 76  1  0  0  0  0
 37 77  1  0  0  0  0
 37 78  1  0  0  0  0
 37 79  1  0  0  0  0
 40 80  1  0  0  0  0
 40 81  1  0  0  0  0
 40 82  1  0  0  0  0
M  CHG  1   5   1
M  END
> <DATABASE_ID>
NP0034227

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H]\C(=C1/C([H])([H])[N@+]2(C([H])([H])[H])[C@@]3([H])O[C@]45N(C6=C([H])C([H])=C(OC([H])([H])[H])C([H])=C6[C@@]4(C3([H])[H])[C@@](C(=O)OC([H])([H])[H])(C([H])([H])OC(=O)C3=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C3[H])[C@@]1([H])C([H])([H])[C@]25[H])C([H])([H])[H])C([H])([H])[H]

> <INCHI_IDENTIFIER>
InChI=1S/C34H41N2O9/c1-9-19-17-36(3)27-15-22(19)32(31(38)43-8,18-44-30(37)20-12-25(40-5)29(42-7)26(13-20)41-6)33-16-28(36)45-34(27,33)35(2)24-11-10-21(39-4)14-23(24)33/h9-14,22,27-28H,15-18H2,1-8H3/q+1/b19-9-/t22-,27-,28-,32-,33-,34-,36-/m0/s1

> <INCHI_KEY>
WHACFBRHAHLZJN-YGWOXRORSA-N

> <FORMULA>
C34H41N2O9

> <MOLECULAR_WEIGHT>
621.706

> <EXACT_MASS>
621.280657328

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
86

> <JCHEM_AVERAGE_POLARIZABILITY>
66.35158141032434

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1R,9S,11S,12S,14E,15S,17S,19R)-14-ethylidene-6-methoxy-19-(methoxycarbonyl)-2,12-dimethyl-19-[(3,4,5-trimethoxybenzoyloxy)methyl]-18-oxa-2,12-diazahexacyclo[9.6.1.1^{9,15}.0^{1,9}.0^{3,8}.0^{12,17}]nonadeca-3,5,7-trien-12-ium

> <ALOGPS_LOGP>
3.48

> <JCHEM_LOGP>
-0.034941955805079125

> <ALOGPS_LOGS>
-6.16

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
-4.138735974705763

> <JCHEM_POLAR_SURFACE_AREA>
101.99000000000002

> <JCHEM_REFRACTIVITY>
176.39739999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
10

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.59e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(1R,9S,11S,12S,14E,15S,17S,19R)-14-ethylidene-6-methoxy-19-(methoxycarbonyl)-2,12-dimethyl-19-[(3,4,5-trimethoxybenzoyloxy)methyl]-18-oxa-2,12-diazahexacyclo[9.6.1.1^{9,15}.0^{1,9}.0^{3,8}.0^{12,17}]nonadeca-3,5,7-trien-12-ium

> <JCHEM_VEBER_RULE>
0

$$$$

     RDKit          3D

 86 92  0  0  0  0  0  0  0  0999 V2000
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 40 82  1  0
M  CHG  1   5   1
M  END

HEADER    PROTEIN                                 20-JUN-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   20-JUN-21         0                                  
HETATM    1  C   UNK     0      -3.349   1.074   2.647  0.00  0.00           C+0
HETATM    2  C   UNK     0      -3.297  -0.397   2.366  0.00  0.00           C+0
HETATM    3  C   UNK     0      -2.609  -1.056   1.408  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.865  -2.535   1.253  0.00  0.00           C+0
HETATM    5  N   UNK     0      -1.843  -3.312   0.465  0.00  0.00           N+1
HETATM    6  C   UNK     0      -2.490  -4.600  -0.044  0.00  0.00           C+0
HETATM    7  C   UNK     0      -0.594  -3.709   1.251  0.00  0.00           C+0
HETATM    8  C   UNK     0       0.008  -2.553   2.044  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.522  -1.610   0.932  0.00  0.00           C+0
HETATM   10  C   UNK     0       2.030  -1.515   0.833  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.938  -1.078   1.786  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.291  -1.014   1.445  0.00  0.00           C+0
HETATM   13  O   UNK     0       5.104  -0.566   2.449  0.00  0.00           O+0
HETATM   14  C   UNK     0       6.493  -0.461   2.159  0.00  0.00           C+0
HETATM   15  C   UNK     0       4.705  -1.387   0.157  0.00  0.00           C+0
HETATM   16  C   UNK     0       3.779  -1.835  -0.797  0.00  0.00           C+0
HETATM   17  C   UNK     0       2.441  -1.911  -0.454  0.00  0.00           C+0
HETATM   18  N   UNK     0       1.362  -2.336  -1.248  0.00  0.00           N+0
HETATM   19  C   UNK     0       1.590  -3.185  -2.397  0.00  0.00           C+0
HETATM   20  C   UNK     0       0.300  -2.558  -0.297  0.00  0.00           C+0
HETATM   21  O   UNK     0       0.405  -3.898   0.262  0.00  0.00           O+0
HETATM   22  C   UNK     0      -1.176  -2.551  -0.744  0.00  0.00           C+0
HETATM   23  C   UNK     0      -1.802  -1.182  -0.922  0.00  0.00           C+0
HETATM   24  C   UNK     0      -1.706  -0.379   0.384  0.00  0.00           C+0
HETATM   25  C   UNK     0      -0.193  -0.201   0.783  0.00  0.00           C+0
HETATM   26  C   UNK     0       0.529   0.689  -0.303  0.00  0.00           C+0
HETATM   27  O   UNK     0      -0.308   1.792  -0.703  0.00  0.00           O+0
HETATM   28  C   UNK     0       0.252   2.637  -1.605  0.00  0.00           C+0
HETATM   29  O   UNK     0       1.331   2.477  -2.150  0.00  0.00           O+0
HETATM   30  C   UNK     0      -0.650   3.790  -1.867  0.00  0.00           C+0
HETATM   31  C   UNK     0      -0.304   4.681  -2.892  0.00  0.00           C+0
HETATM   32  C   UNK     0      -1.113   5.785  -3.171  0.00  0.00           C+0
HETATM   33  O   UNK     0      -0.860   6.707  -4.154  0.00  0.00           O+0
HETATM   34  C   UNK     0       0.292   6.513  -4.965  0.00  0.00           C+0
HETATM   35  C   UNK     0      -2.276   5.999  -2.403  0.00  0.00           C+0
HETATM   36  O   UNK     0      -3.059   7.098  -2.665  0.00  0.00           O+0
HETATM   37  C   UNK     0      -2.532   8.248  -1.999  0.00  0.00           C+0
HETATM   38  C   UNK     0      -2.653   5.085  -1.408  0.00  0.00           C+0
HETATM   39  O   UNK     0      -3.764   5.150  -0.608  0.00  0.00           O+0
HETATM   40  C   UNK     0      -4.940   5.675  -1.218  0.00  0.00           C+0
HETATM   41  C   UNK     0      -1.818   4.002  -1.125  0.00  0.00           C+0
HETATM   42  C   UNK     0      -0.064   0.559   2.118  0.00  0.00           C+0
HETATM   43  O   UNK     0       0.115   0.014   3.200  0.00  0.00           O+0
HETATM   44  O   UNK     0      -0.201   1.902   1.972  0.00  0.00           O+0
HETATM   45  C   UNK     0       0.014   2.665   3.164  0.00  0.00           C+0
HETATM   46  H   UNK     0      -2.918   1.277   3.632  0.00  0.00           H+0
HETATM   47  H   UNK     0      -2.830   1.681   1.905  0.00  0.00           H+0
HETATM   48  H   UNK     0      -4.393   1.403   2.662  0.00  0.00           H+0
HETATM   49  H   UNK     0      -3.947  -0.965   3.035  0.00  0.00           H+0
HETATM   50  H   UNK     0      -3.817  -2.644   0.716  0.00  0.00           H+0
HETATM   51  H   UNK     0      -2.970  -3.038   2.223  0.00  0.00           H+0
HETATM   52  H   UNK     0      -3.290  -4.328  -0.739  0.00  0.00           H+0
HETATM   53  H   UNK     0      -2.895  -5.144   0.815  0.00  0.00           H+0
HETATM   54  H   UNK     0      -1.735  -5.204  -0.556  0.00  0.00           H+0
HETATM   55  H   UNK     0      -0.783  -4.608   1.847  0.00  0.00           H+0
HETATM   56  H   UNK     0      -0.703  -2.130   2.753  0.00  0.00           H+0
HETATM   57  H   UNK     0       0.848  -2.930   2.642  0.00  0.00           H+0
HETATM   58  H   UNK     0       2.621  -0.780   2.781  0.00  0.00           H+0
HETATM   59  H   UNK     0       6.921  -1.440   1.920  0.00  0.00           H+0
HETATM   60  H   UNK     0       6.995  -0.089   3.058  0.00  0.00           H+0
HETATM   61  H   UNK     0       6.675   0.259   1.354  0.00  0.00           H+0
HETATM   62  H   UNK     0       5.749  -1.339  -0.138  0.00  0.00           H+0
HETATM   63  H   UNK     0       4.129  -2.112  -1.785  0.00  0.00           H+0
HETATM   64  H   UNK     0       2.040  -4.139  -2.102  0.00  0.00           H+0
HETATM   65  H   UNK     0       2.244  -2.694  -3.126  0.00  0.00           H+0
HETATM   66  H   UNK     0       0.647  -3.399  -2.910  0.00  0.00           H+0
HETATM   67  H   UNK     0      -1.325  -3.169  -1.637  0.00  0.00           H+0
HETATM   68  H   UNK     0      -2.852  -1.287  -1.228  0.00  0.00           H+0
HETATM   69  H   UNK     0      -1.311  -0.654  -1.747  0.00  0.00           H+0
HETATM   70  H   UNK     0      -2.144   0.603   0.176  0.00  0.00           H+0
HETATM   71  H   UNK     0       1.473   1.091   0.086  0.00  0.00           H+0
HETATM   72  H   UNK     0       0.737   0.119  -1.211  0.00  0.00           H+0
HETATM   73  H   UNK     0       0.606   4.493  -3.455  0.00  0.00           H+0
HETATM   74  H   UNK     0       0.231   5.570  -5.519  0.00  0.00           H+0
HETATM   75  H   UNK     0       1.208   6.565  -4.368  0.00  0.00           H+0
HETATM   76  H   UNK     0       0.326   7.327  -5.697  0.00  0.00           H+0
HETATM   77  H   UNK     0      -1.565   8.547  -2.416  0.00  0.00           H+0
HETATM   78  H   UNK     0      -2.443   8.076  -0.920  0.00  0.00           H+0
HETATM   79  H   UNK     0      -3.234   9.072  -2.153  0.00  0.00           H+0
HETATM   80  H   UNK     0      -5.043   5.366  -2.264  0.00  0.00           H+0
HETATM   81  H   UNK     0      -5.800   5.272  -0.672  0.00  0.00           H+0
HETATM   82  H   UNK     0      -4.972   6.763  -1.115  0.00  0.00           H+0
HETATM   83  H   UNK     0      -2.100   3.327  -0.321  0.00  0.00           H+0
HETATM   84  H   UNK     0      -0.117   3.722   2.915  0.00  0.00           H+0
HETATM   85  H   UNK     0      -0.717   2.396   3.932  0.00  0.00           H+0
HETATM   86  H   UNK     0       1.034   2.517   3.530  0.00  0.00           H+0
CONECT    1    2   46   47   48                                             
CONECT    2    3    1   49                                                  
CONECT    3   24    4    2                                                  
CONECT    4    5    3   50   51                                             
CONECT    5   22    4    6    7                                             
CONECT    6    5   52   53   54                                             
CONECT    7   21    5    8   55                                             
CONECT    8    9    7   56   57                                             
CONECT    9   20   25   10    8                                             
CONECT   10   11   17    9                                                  
CONECT   11   12   10   58                                                  
CONECT   12   11   13   15                                                  
CONECT   13   12   14                                                       
CONECT   14   13   59   60   61                                             
CONECT   15   16   12   62                                                  
CONECT   16   17   15   63                                                  
CONECT   17   16   10   18                                                  
CONECT   18   17   20   19                                                  
CONECT   19   18   64   65   66                                             
CONECT   20    9   21   18   22                                             
CONECT   21   20    7                                                       
CONECT   22    5   67   23   20                                             
CONECT   23   22   24   68   69                                             
CONECT   24   25   23    3   70                                             
CONECT   25   24   26   42    9                                             
CONECT   26   25   27   71   72                                             
CONECT   27   26   28                                                       
CONECT   28   27   29   30                                                  
CONECT   29   28                                                            
CONECT   30   28   31   41                                                  
CONECT   31   30   32   73                                                  
CONECT   32   31   35   33                                                  
CONECT   33   32   34                                                       
CONECT   34   33   74   75   76                                             
CONECT   35   32   38   36                                                  
CONECT   36   35   37                                                       
CONECT   37   36   77   78   79                                             
CONECT   38   35   41   39                                                  
CONECT   39   38   40                                                       
CONECT   40   39   80   81   82                                             
CONECT   41   38   30   83                                                  
CONECT   42   25   44   43                                                  
CONECT   43   42                                                            
CONECT   44   42   45                                                       
CONECT   45   44   84   85   86                                             
CONECT   46    1                                                            
CONECT   47    1                                                            
CONECT   48    1                                                            
CONECT   49    2                                                            
CONECT   50    4                                                            
CONECT   51    4                                                            
CONECT   52    6                                                            
CONECT   53    6                                                            
CONECT   54    6                                                            
CONECT   55    7                                                            
CONECT   56    8                                                            
CONECT   57    8                                                            
CONECT   58   11                                                            
CONECT   59   14                                                            
CONECT   60   14                                                            
CONECT   61   14                                                            
CONECT   62   15                                                            
CONECT   63   16                                                            
CONECT   64   19                                                            
CONECT   65   19                                                            
CONECT   66   19                                                            
CONECT   67   22                                                            
CONECT   68   23                                                            
CONECT   69   23                                                            
CONECT   70   24                                                            
CONECT   71   26                                                            
CONECT   72   26                                                            
CONECT   73   31                                                            
CONECT   74   34                                                            
CONECT   75   34                                                            
CONECT   76   34                                                            
CONECT   77   37                                                            
CONECT   78   37                                                            
CONECT   79   37                                                            
CONECT   80   40                                                            
CONECT   81   40                                                            
CONECT   82   40                                                            
CONECT   83   41                                                            
CONECT   84   45                                                            
CONECT   85   45                                                            
CONECT   86   45                                                            
MASTER        0    0    0    0    0    0    0    0   86    0  184    0
END

RDKit          3D

86 92  0  0  0  0  0  0  0  0999 V2000
   -3.3491    1.0736    2.6474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2969   -0.3968    2.3657 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.8483   -2.9299    2.6418 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6212   -0.7802    2.7813 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9210   -1.4401    1.9198 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9948   -0.0889    3.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6745    0.2586    1.3540 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7485   -1.3389   -0.1383 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1287   -2.1121   -1.7853 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0401   -4.1390   -2.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2439   -2.6942   -3.1255 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6473   -3.3987   -2.9096 H   0  0  0  0  0  0  0  0  0  0  0  0
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  4 51  1  0
  2 49  1  0
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 34 76  1  0
 37 77  1  0
 37 78  1  0
 37 79  1  0
 40 80  1  0
 40 81  1  0
 40 82  1  0
M  CHG  1   5   1
M  END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₄H₄₁N₂O₉

Average Mass

621.7060 Da

Monoisotopic Mass

621.28066 Da

IUPAC Name

(1R,9S,11S,12S,14E,15S,17S,19R)-14-ethylidene-6-methoxy-19-(methoxycarbonyl)-2,12-dimethyl-19-[(3,4,5-trimethoxybenzoyloxy)methyl]-18-oxa-2,12-diazahexacyclo[9.6.1.1^{9,15}.0^{1,9}.0^{3,8}.0^{12,17}]nonadeca-3,5,7-trien-12-ium

Traditional Name

CAS Registry Number

Not Available

SMILES

[H]\C(=C1/C([H])([H])[N@+]2(C([H])([H])[H])[C@@]3([H])O[C@]45N(C6=C([H])C([H])=C(OC([H])([H])[H])C([H])=C6[C@@]4(C3([H])[H])[C@@](C(=O)OC([H])([H])[H])(C([H])([H])OC(=O)C3=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C3[H])[C@@]1([H])C([H])([H])[C@]25[H])C([H])([H])[H])C([H])([H])[H]

InChI Identifier

InChI=1S/C34H41N2O9/c1-9-19-17-36(3)27-15-22(19)32(31(38)43-8,18-44-30(37)20-12-25(40-5)29(42-7)26(13-20)41-6)33-16-28(36)45-34(27,33)35(2)24-11-10-21(39-4)14-23(24)33/h9-14,22,27-28H,15-18H2,1-8H3/q+1/b19-9-/t22-,27-,28-,32-,33-,34-,36-/m0/s1

InChI Key

WHACFBRHAHLZJN-YGWOXRORSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 400 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 100 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 200 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 300 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 500 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 600 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 700 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 800 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 900 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, CD₃OD, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Alstonia macrophylla	JEOL database	Hirasawa, Y., et al, J. Nat. Prod. 72, 304 (2009)

Chemical Taxonomy

Classification

Not classified

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	3.48	ALOGPS
logP	-0.035	ChemAxon
logS	-6.2	ALOGPS
pKa (Strongest Basic)	-4.1	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	101.99 Å²	ChemAxon
Rotatable Bond Count	10	ChemAxon
Refractivity	176.4 m³·mol⁻¹	ChemAxon
Polarizability	66.35 Å³	ChemAxon
Number of Rings	7	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

External Links

Not Available

References

General References

Hirasawa, Y., et al. (2009). Hirasawa, Y., et al, J. Nat. Prod. 72, 304 (2009). J. Nat. Prod..

Showing NP-Card for alstiphyllanine C (NP0034227)

MOL for NP0034227 (alstiphyllanine C)

3D MOL for NP0034227 (alstiphyllanine C)

3D SDF for NP0034227 (alstiphyllanine C)

3D-SDF for NP0034227 (alstiphyllanine C)

PDB for NP0034227 (alstiphyllanine C)

3D PDB for NP0034227 (alstiphyllanine C)

SMILES for NP0034227 (alstiphyllanine C)

INCHI for NP0034227 (alstiphyllanine C)

Structure for NP0034227 (alstiphyllanine C)

3D Structure for NP0034227 (alstiphyllanine C)