NP-MRD: Showing NP-Card for 8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol (NP0146147)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2022-09-02 01:29:10 UTC

Updated at

2022-09-02 01:29:10 UTC

NP-MRD ID

NP0146147

Secondary Accession Numbers

None

Natural Product Identification

Common Name

8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol

Description

8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol is found in Murraya euchrestifolia.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309022203292D          

 54 59  0  0  0  0            999 V2000
    8.2896   -4.3495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0346   -3.5648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2276   -3.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9727   -2.6087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1657   -2.4372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6137   -3.0503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8686   -3.8349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2012   -4.3198    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5338   -3.8349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7268   -4.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4718   -4.7910    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1748   -3.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3678   -3.5648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8158   -2.9517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0707   -2.1671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0088   -3.1233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7538   -3.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3059   -4.5210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8934   -5.2355    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0864   -5.0639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5810   -5.5489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4948   -6.3693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1622   -6.8543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0760   -7.6747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3223   -8.0103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7434   -8.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4971   -7.8241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1646   -8.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9182   -7.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5857   -8.4584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0045   -7.1530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3347   -5.2133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0022   -5.6982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7558   -5.3627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4209   -4.3928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7535   -3.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0002   -4.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1128   -4.3495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6649   -4.9626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4297   -2.6087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8777   -1.9956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2367   -2.4372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7887   -3.0503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6756   -4.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9305   -4.7910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7375   -4.9626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9925   -5.7472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7994   -5.9187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4404   -6.3603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6335   -6.1887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0814   -6.8018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2745   -6.6303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7224   -7.2434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0195   -5.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 21 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 32 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 20 37  2  0  0  0  0
 17 37  1  0  0  0  0
 18 38  1  0  0  0  0
 13 38  2  0  0  0  0
 38 39  1  0  0  0  0
 12 40  1  0  0  0  0
 40 41  1  0  0  0  0
 40 42  2  0  0  0  0
 42 43  1  0  0  0  0
  9 43  2  0  0  0  0
  6 43  1  0  0  0  0
  7 44  1  0  0  0  0
  3 44  2  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
 46 47  2  0  0  0  0
 47 48  1  0  0  0  0
 47 49  1  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 51 52  2  0  0  0  0
 52 53  1  0  0  0  0
 52 54  1  0  0  0  0
M  END

     RDKit          3D

110115  0  0  0  0  0  0  0  0999 V2000
    8.5671   -2.1194    3.0845 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7230   -1.2778    2.3604 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4480   -1.6494    1.9380 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9855   -2.9178    2.2485 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7227   -3.3158    1.8425 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9323   -2.4331    1.1257 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3629   -1.1629    0.8004 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3976   -0.5335    0.1081 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3252   -1.3472   -0.0432 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1020   -1.1974   -0.6610 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8032    0.0096   -1.2882 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2206   -2.2506   -0.6340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0831   -2.0936   -1.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1634   -2.3965   -2.6268 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0281   -2.8739   -3.3462 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3855   -2.2463   -3.2926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4821   -1.8009   -2.6071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4155   -1.4943   -1.2701 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6255   -1.0839   -0.8479 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4680   -1.1245   -1.9042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8258   -0.7968   -1.9972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5807   -0.3336   -0.8130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2743    1.0532   -0.4045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1630    2.0466   -0.3640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5538    1.7781   -0.7471 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6774    3.3825    0.0879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4446    3.8380    1.3282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2977    2.8899    2.4553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2977    2.2703    3.0355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0055    1.3310    4.1715 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7032    2.4360    2.6447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5007   -0.9088   -3.1913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8402   -0.5817   -3.2670 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4828   -0.7181   -4.5270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7863   -1.3540   -4.2798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4533   -1.6813   -4.2096 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7876   -1.5648   -3.0084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1995   -1.6474   -0.6237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1435   -1.3366    0.7172 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5403   -3.4342   -0.0068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4563   -4.5464   -0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7585   -3.5997    0.6157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6482   -2.5299    0.5856 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6335   -0.7988    1.2232 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1110    0.5686    0.8557 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0633    0.5166   -0.2757 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3064    0.9530   -0.2731 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1405    0.8150   -1.5336 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9320    1.5762    0.8922 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3881    2.9996    0.5998 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0284    3.6383    1.7779 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2881    4.0625    1.7464 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9121    4.6980    2.9287 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0533    3.8735    0.4845 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9352   -2.9516    2.4757 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0414   -2.5545    3.9613 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3963   -1.4752    3.4888 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6304   -3.5853    2.8117 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3395   -4.2897    2.0682 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4334    0.4325   -0.2706 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4478    0.7855   -1.3102 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6854   -2.0451   -3.6865 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6255   -3.6120   -2.7701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3009   -3.3953   -4.2770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4228   -2.4903   -4.3413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9129   -0.7814    0.1008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6809   -0.4637   -0.9771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3611   -0.9858    0.0803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2199    1.2367   -0.1202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6711    1.5936   -1.8289 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2217    2.6340   -0.5032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9765    0.9081   -0.2148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6119    3.3323    0.3817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8525    4.1557   -0.6882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9422    4.7941    1.6561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4776    4.0950    1.1015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2752    2.7028    2.8183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6457    1.6732    5.0156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3297    0.3219    3.8492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9301    1.3236    4.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9510    3.4611    2.3267 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0111    1.7012    1.8711 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3397    2.2675    3.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9370   -0.1346   -5.3162 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5123   -0.3652   -4.5065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3960   -1.7827   -4.8587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3326   -1.4400   -5.2266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9467   -2.0228   -5.0885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2805   -1.4371    1.2078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3150   -4.2268    0.6380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8173   -4.6453   -1.0406 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0141   -5.4545    0.3791 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0478   -4.5088    1.1179 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2050    1.1228    0.4637 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4252    1.1307    1.7261 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7314    0.0728   -1.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6403    1.7729   -1.7816 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5179    0.4734   -2.3823 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8839    0.0225   -1.3049 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3261    1.4819    1.7796 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8977    1.0259    1.1353 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5238    3.6117    0.2203 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1315    2.9835   -0.2208 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4487    3.7585    2.6847 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6016    4.0013    3.4294 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1934    5.0448    3.6711 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5232    5.5937    2.6370 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1036    2.7876    0.2441 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5455    4.4608   -0.3035 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0511    4.3195    0.6191 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 44  2  0
 44 45  1  0
 45 46  1  0
 46 47  2  0
 47 48  1  0
 47 49  1  0
 49 50  1  0
 50 51  1  0
 51 52  2  3
 52 53  1  0
 52 54  1  0
 44  7  1  0
  7  6  2  0
  6  5  1  0
  5  4  2  0
  6 43  1  0
 43  9  2  0
  9  8  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12 40  1  0
 40 41  1  0
 40 42  2  0
 12 13  1  0
 13 38  2  0
 38 39  1  0
 38 18  1  0
 18 17  2  0
 17 16  1  0
 16 14  2  0
 14 15  1  0
 17 37  1  0
 37 20  2  0
 20 19  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  2  3
 29 30  1  0
 29 31  1  0
 21 32  2  0
 32 33  1  0
 33 34  1  0
 32 35  1  0
 35 36  2  0
  4  3  1  0
 42 43  1  0
 14 13  1  0
 36 37  1  0
  8  7  1  0
 19 18  1  0
  1 55  1  0
  1 56  1  0
  1 57  1  0
 45 94  1  0
 45 95  1  0
 46 96  1  0
 48 97  1  0
 48 98  1  0
 48 99  1  0
 49100  1  0
 49101  1  0
 50102  1  0
 50103  1  0
 51104  1  0
 53105  1  0
 53106  1  0
 53107  1  0
 54108  1  0
 54109  1  0
 54110  1  0
  5 59  1  0
  4 58  1  0
  8 60  1  0
 11 61  1  0
 41 90  1  0
 41 91  1  0
 41 92  1  0
 42 93  1  0
 39 89  1  0
 16 65  1  0
 15 62  1  0
 15 63  1  0
 15 64  1  0
 19 66  1  0
 22 67  1  0
 22 68  1  0
 23 69  1  0
 25 70  1  0
 25 71  1  0
 25 72  1  0
 26 73  1  0
 26 74  1  0
 27 75  1  0
 27 76  1  0
 28 77  1  0
 30 78  1  0
 30 79  1  0
 30 80  1  0
 31 81  1  0
 31 82  1  0
 31 83  1  0
 34 84  1  0
 34 85  1  0
 34 86  1  0
 35 87  1  0
 36 88  1  0
M  END


  Mrv1652309022203292D          

 54 59  0  0  0  0            999 V2000
    8.2896   -4.3495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0346   -3.5648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2276   -3.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9727   -2.6087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1657   -2.4372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6137   -3.0503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8686   -3.8349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2012   -4.3198    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5338   -3.8349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7268   -4.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4718   -4.7910    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1748   -3.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3678   -3.5648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8158   -2.9517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0707   -2.1671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0088   -3.1233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7538   -3.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3059   -4.5210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8934   -5.2355    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0864   -5.0639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5810   -5.5489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4948   -6.3693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1622   -6.8543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0760   -7.6747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3223   -8.0103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7434   -8.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4971   -7.8241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1646   -8.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9182   -7.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5857   -8.4584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0045   -7.1530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3347   -5.2133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0022   -5.6982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7558   -5.3627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4209   -4.3928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7535   -3.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0002   -4.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1128   -4.3495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6649   -4.9626    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4297   -2.6087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8777   -1.9956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2367   -2.4372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7887   -3.0503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6756   -4.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9305   -4.7910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7375   -4.9626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9925   -5.7472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7994   -5.9187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4404   -6.3603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6335   -6.1887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0814   -6.8018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2745   -6.6303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7224   -7.2434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0195   -5.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 21 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 32 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 20 37  2  0  0  0  0
 17 37  1  0  0  0  0
 18 38  1  0  0  0  0
 13 38  2  0  0  0  0
 38 39  1  0  0  0  0
 12 40  1  0  0  0  0
 40 41  1  0  0  0  0
 40 42  2  0  0  0  0
 42 43  1  0  0  0  0
  9 43  2  0  0  0  0
  6 43  1  0  0  0  0
  7 44  1  0  0  0  0
  3 44  2  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
 46 47  2  0  0  0  0
 47 48  1  0  0  0  0
 47 49  1  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 51 52  2  0  0  0  0
 52 53  1  0  0  0  0
 52 54  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0146147

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C(C\C=C(\C)CCC=C(C)C)C2=C(C=C1)C1=C(N2)C(O)=C(C(C)=C1)C1=C(O)C2=C(C=C1C)C1=C(N2)C(C\C=C(/C)CCC=C(C)C)=C(OC)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C48H56N2O4/c1-27(2)13-11-15-29(5)17-19-35-39(53-9)23-21-33-37-25-31(7)41(47(51)45(37)49-43(33)35)42-32(8)26-38-34-22-24-40(54-10)36(44(34)50-46(38)48(42)52)20-18-30(6)16-12-14-28(3)4/h13-14,17-18,21-26,49-52H,11-12,15-16,19-20H2,1-10H3/b29-17-,30-18+

> <INCHI_KEY>
YBPCZVAPCCHDDP-QCOHSWCKSA-N

> <FORMULA>
C48H56N2O4

> <MOLECULAR_WEIGHT>
724.986

> <EXACT_MASS>
724.424008291

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
110

> <JCHEM_AVERAGE_POLARIZABILITY>
88.51978873766359

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
8-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9H,9'H-[2,2'-bicarbazole]-1,1'-diol

> <ALOGPS_LOGP>
8.48

> <JCHEM_LOGP>
12.736683077333335

> <ALOGPS_LOGS>
-6.61

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.944658090395153

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.129115928522115

> <JCHEM_PKA_STRONGEST_BASIC>
-4.535882310258954

> <JCHEM_POLAR_SURFACE_AREA>
90.5

> <JCHEM_REFRACTIVITY>
229.08400000000006

> <JCHEM_ROTATABLE_BOND_COUNT>
12

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.79e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
8-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9H,9'H-[2,2'-bicarbazole]-1,1'-diol

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 02-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-SEP-22         0                                  
HETATM    1  C   UNK     0      15.474  -8.119   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0      14.998  -6.654   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0      13.492  -6.334   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      13.016  -4.870   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      11.509  -4.549   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      10.479  -5.694   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      10.955  -7.158   0.000  0.00  0.00           C+0
HETATM    8  N   UNK     0       9.709  -8.064   0.000  0.00  0.00           N+0
HETATM    9  C   UNK     0       8.463  -7.158   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.957  -7.479   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       6.481  -8.943   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0       5.926  -6.334   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.420  -6.654   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       3.389  -5.510   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.865  -4.045   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.883  -5.830   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       1.407  -7.295   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       2.438  -8.439   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0       1.668  -9.773   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       0.161  -9.453   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -1.085 -10.358   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -0.924 -11.889   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -2.170 -12.795   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -2.009 -14.326   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -0.602 -14.953   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -3.254 -15.231   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -4.661 -14.605   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -5.907 -15.510   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      -7.314 -14.884   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -8.560 -15.789   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -7.475 -13.352   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      -2.491  -9.731   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      -3.737 -10.637   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0      -5.144 -10.010   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      -2.652  -8.200   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      -1.407  -7.295   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       0.000  -7.921   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0       3.944  -8.119   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0       4.974  -9.263   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0       6.402  -4.870   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       5.372  -3.725   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0       7.908  -4.549   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0       8.939  -5.694   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0      12.461  -7.479   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0      12.937  -8.943   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0      14.443  -9.263   0.000  0.00  0.00           C+0
HETATM   47  C   UNK     0      14.919 -10.728   0.000  0.00  0.00           C+0
HETATM   48  C   UNK     0      16.426 -11.048   0.000  0.00  0.00           C+0
HETATM   49  C   UNK     0      13.889 -11.873   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0      12.382 -11.552   0.000  0.00  0.00           C+0
HETATM   51  C   UNK     0      11.352 -12.697   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0       9.846 -12.377   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0       8.815 -13.521   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0       9.370 -10.912   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   44                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7   43                                                  
CONECT    7    6    8   44                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   43                                                  
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13   40                                                  
CONECT   13   12   14   38                                                  
CONECT   14   13   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17                                                       
CONECT   17   16   18   37                                                  
CONECT   18   17   19   38                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   37                                                  
CONECT   21   20   22   32                                                  
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   29                                                       
CONECT   29   28   30   31                                                  
CONECT   30   29                                                            
CONECT   31   29                                                            
CONECT   32   21   33   35                                                  
CONECT   33   32   34                                                       
CONECT   34   33                                                            
CONECT   35   32   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   20   17                                                  
CONECT   38   18   13   39                                                  
CONECT   39   38                                                            
CONECT   40   12   41   42                                                  
CONECT   41   40                                                            
CONECT   42   40   43                                                       
CONECT   43   42    9    6                                                  
CONECT   44    7    3   45                                                  
CONECT   45   44   46                                                       
CONECT   46   45   47                                                       
CONECT   47   46   48   49                                                  
CONECT   48   47                                                            
CONECT   49   47   50                                                       
CONECT   50   49   51                                                       
CONECT   51   50   52                                                       
CONECT   52   51   53   54                                                  
CONECT   53   52                                                            
CONECT   54   52                                                            
MASTER        0    0    0    0    0    0    0    0   54    0  118    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₈H₅₆N₂O₄

Average Mass

724.9860 Da

Monoisotopic Mass

724.42401 Da

IUPAC Name

8-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9H,9'H-[2,2'-bicarbazole]-1,1'-diol

Traditional Name

8-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9H,9'H-[2,2'-bicarbazole]-1,1'-diol

CAS Registry Number

Not Available

SMILES

COC1=C(C\C=C(\C)CCC=C(C)C)C2=C(C=C1)C1=C(N2)C(O)=C(C(C)=C1)C1=C(O)C2=C(C=C1C)C1=C(N2)C(C\C=C(/C)CCC=C(C)C)=C(OC)C=C1

InChI Identifier

InChI=1S/C48H56N2O4/c1-27(2)13-11-15-29(5)17-19-35-39(53-9)23-21-33-37-25-31(7)41(47(51)45(37)49-43(33)35)42-32(8)26-38-34-22-24-40(54-10)36(44(34)50-46(38)48(42)52)20-18-30(6)16-12-14-28(3)4/h13-14,17-18,21-26,49-52H,11-12,15-16,19-20H2,1-10H3/b29-17-,30-18+

InChI Key

YBPCZVAPCCHDDP-QCOHSWCKSA-N

Experimental Spectra

Not Available

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Murraya euchrestifolia	LOTUS Database	35616633

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	8.48	ALOGPS
logP	12.74	ChemAxon
logS	-6.6	ALOGPS
pKa (Strongest Acidic)	9.13	ChemAxon
pKa (Strongest Basic)	-4.5	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	90.5 Å²	ChemAxon
Rotatable Bond Count	12	ChemAxon
Refractivity	229.08 m³·mol⁻¹	ChemAxon
Polarizability	88.52 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	No	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

LOTUS database [Link]

Showing NP-Card for 8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol (NP0146147)

MOL for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

3D MOL for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

3D SDF for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

3D-SDF for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

PDB for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

3D PDB for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

SMILES for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

INCHI for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

Structure for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)

3D Structure for NP0146147 (8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-8'-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-7,7'-dimethoxy-3,3'-dimethyl-9h,9'h-[2,2'-bicarbazole]-1,1'-diol)