NP-MRD: Showing NP-Card for 8-epi-euonymine (NP0332037)

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Record Information

Version

2.0

Created at

2023-10-31 04:10:29 UTC

Updated at

2024-09-03 04:17:47 UTC

NP-MRD ID

NP0332037

Natural Product DOI

https://doi.org/10.57994/1165

Secondary Accession Numbers

None

Natural Product Identification

Common Name

8-epi-euonymine

Description

Based on a literature review very few articles have been published on 8-epi-euonymine.

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 10312304102D          

 58 62  0  0  1  0            999 V2000
    0.9497   -0.7035    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5084   -1.3559    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3447   -1.5616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1492   -0.8244    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5431   -0.2859    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4390   -0.1119    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.2369   -0.3694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1129   -0.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9871    0.1111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1817    0.8151    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6148    0.5572    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.3227    0.5496    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.1816    1.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1899    0.6676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0619    0.6412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8961    0.4816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5206   -0.0871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7030   -0.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4481   -1.7436    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.1081   -2.3024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8466   -2.3481    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.3167   -3.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4910   -1.1360    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0966   -0.5758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9142    0.2288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1262    0.4731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1766    1.3073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7710    1.3673    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4402    0.2189    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6857    1.1714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6461    2.1043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3079    2.6735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1031    2.7695    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6083   -0.6364    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.6855   -0.4934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6037    0.1521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5135   -0.0226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0983    0.8755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9272   -1.1921    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7353   -1.7597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5626   -2.1784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4642   -2.3687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3306   -2.3234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4605   -3.2081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9386   -2.0573    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3559   -2.9538    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7988   -3.8464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7226   -4.7108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5369   -4.2817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2617   -2.5364    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0744   -3.4213    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4905   -2.1755    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2360   -2.5433    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0557   -2.6342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2827   -3.4677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  4  2  1  0  0  0  0
  4  5  1  1  0  0  0
  4  6  1  0  0  0  0
  6  7  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  5  1  0  0  0  0
 12 13  1  1  0  0  0
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 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 19 18  1  0  0  0  0
 19 20  1  1  0  0  0
 19 21  1  0  0  0  0
 21 22  1  6  0  0  0
 18 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 17 26  1  0  0  0  0
 16 27  2  0  0  0  0
 11 28  1  6  0  0  0
 11 29  1  0  0  0  0
 29 30  1  1  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
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 34 29  1  0  0  0  0
 34 35  1  6  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 36 38  2  0  0  0  0
 39 34  1  0  0  0  0
  4 39  1  0  0  0  0
 39 40  1  6  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 42 44  2  0  0  0  0
 39 45  1  0  0  0  0
 45 46  1  6  0  0  0
 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 47 49  2  0  0  0  0
 45 50  1  0  0  0  0
 50 51  1  6  0  0  0
 51 52  1  0  0  0  0
 52 53  1  0  0  0  0
 52 54  2  0  0  0  0
 55 50  1  0  0  0  0
  2 55  1  0  0  0  0
 55 56  1  1  0  0  0
 56 57  1  0  0  0  0
 21 57  1  0  0  0  0
 57 58  2  0  0  0  0
M  END


  Mrv2104 10312304102D          

 58 62  0  0  1  0            999 V2000
    0.9497   -0.7035    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1492   -0.8244    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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   -2.1129   -0.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  8  9  1  0  0  0  0
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 39 45  1  0  0  0  0
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 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 47 49  2  0  0  0  0
 45 50  1  0  0  0  0
 50 51  1  6  0  0  0
 51 52  1  0  0  0  0
 52 53  1  0  0  0  0
 52 54  2  0  0  0  0
 55 50  1  0  0  0  0
  2 55  1  0  0  0  0
 55 56  1  1  0  0  0
 56 57  1  0  0  0  0
 21 57  1  0  0  0  0
 57 58  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0332037

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]12[C@@H](OC(C)=O)[C@@]34O[C@@]1(C)COC(=O)C1=C(N=CC=C1)[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(COC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@]4(C)O

> <INCHI_IDENTIFIER>
InChI=1S/C38H47NO18/c1-16-17(2)33(46)56-30-28(52-20(5)42)32(55-23(8)45)37(15-49-18(3)40)31(54-22(7)44)27(51-19(4)41)25-29(53-21(6)43)38(37,36(30,10)48)57-35(25,9)14-50-34(47)24-12-11-13-39-26(16)24/h11-13,16-17,25,27-32,48H,14-15H2,1-10H3/t16-,17-,25+,27-,28-,29+,30-,31+,32-,35-,36-,37+,38-/m0/s1

> <INCHI_KEY>
PBFGAFDJVQAMRS-CZQNRJKOSA-N

> <FORMULA>
C38H47NO18

> <MOLECULAR_WEIGHT>
805.783

> <EXACT_MASS>
805.279313677

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_ATOM_COUNT>
104

> <JCHEM_AVERAGE_POLARIZABILITY>
78.92352795880437

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
[(1S,3R,13S,14S,17S,18R,19R,20R,21S,22S,23R,24R,25S)-18,19,21,22,24-pentakis(acetyloxy)-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0^{1,20}.0^{3,23}.0^{7,12}]pentacosa-7(12),8,10-trien-20-yl]methyl acetate

> <JCHEM_LOGP>
-0.24297890500000102

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.735276404277

> <JCHEM_PKA_STRONGEST_BASIC>
2.6118354072845946

> <JCHEM_POLAR_SURFACE_AREA>
252.74999999999991

> <JCHEM_REFRACTIVITY>
182.79660000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
[(1S,3R,13S,14S,17S,18R,19R,20R,21S,22S,23R,24R,25S)-18,19,21,22,24-pentakis(acetyloxy)-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0^{1,20}.0^{3,23}.0^{7,12}]pentacosa-7(12),8,10-trien-20-yl]methyl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 31-OCT-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   31-OCT-23         0                                  
HETATM    1  O   UNK     0       1.773  -1.313   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       0.949  -2.531   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.510  -2.915   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -0.279  -1.539   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       1.014  -0.534   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -0.819  -0.209   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      -2.309  -0.690   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0      -3.944  -0.056   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -5.576   0.207   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -4.073   1.522   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0      -1.148   1.040   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.602   1.026   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       0.339   2.611   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.221   1.246   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       3.849   1.197   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       5.406   0.899   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.572  -0.163   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.912  -1.665   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.437  -3.255   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       7.668  -4.298   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       5.314  -4.383   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       6.191  -5.738   0.000  0.00  0.00           C+0
HETATM   23  N   UNK     0       8.383  -2.121   0.000  0.00  0.00           N+0
HETATM   24  C   UNK     0       9.514  -1.075   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       9.173   0.427   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       7.702   0.883   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       5.930   2.440   0.000  0.00  0.00           O+0
HETATM   28  H   UNK     0      -1.439   2.552   0.000  0.00  0.00           H+0
HETATM   29  C   UNK     0      -2.688   0.409   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0      -3.147   2.187   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0      -3.073   3.928   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      -4.308   4.991   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      -2.059   5.170   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0      -3.002  -1.188   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      -5.013  -0.921   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0      -6.727   0.284   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      -8.425  -0.042   0.000  0.00  0.00           C+0
HETATM   38  O   UNK     0      -7.650   1.634   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0      -1.731  -2.225   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      -3.239  -3.285   0.000  0.00  0.00           C+0
HETATM   41  O   UNK     0      -4.784  -4.066   0.000  0.00  0.00           O+0
HETATM   42  C   UNK     0      -6.466  -4.422   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0      -8.084  -4.337   0.000  0.00  0.00           C+0
HETATM   44  O   UNK     0      -6.460  -5.988   0.000  0.00  0.00           O+0
HETATM   45  C   UNK     0      -1.752  -3.840   0.000  0.00  0.00           C+0
HETATM   46  O   UNK     0      -2.531  -5.514   0.000  0.00  0.00           O+0
HETATM   47  C   UNK     0      -3.358  -7.180   0.000  0.00  0.00           C+0
HETATM   48  C   UNK     0      -3.215  -8.794   0.000  0.00  0.00           C+0
HETATM   49  O   UNK     0      -4.736  -7.993   0.000  0.00  0.00           O+0
HETATM   50  C   UNK     0      -0.489  -4.735   0.000  0.00  0.00           C+0
HETATM   51  O   UNK     0      -0.139  -6.387   0.000  0.00  0.00           O+0
HETATM   52  C   UNK     0       0.232  -8.014   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0       1.634  -8.778   0.000  0.00  0.00           C+0
HETATM   54  O   UNK     0      -0.009  -9.652   0.000  0.00  0.00           O+0
HETATM   55  C   UNK     0       0.916  -4.061   0.000  0.00  0.00           C+0
HETATM   56  O   UNK     0       2.307  -4.747   0.000  0.00  0.00           O+0
HETATM   57  C   UNK     0       3.837  -4.917   0.000  0.00  0.00           C+0
HETATM   58  O   UNK     0       4.261  -6.473   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4   55                                             
CONECT    3    2                                                            
CONECT    4    2    5    6   39                                             
CONECT    5    4   12                                                       
CONECT    6    4    7   11                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8                                                            
CONECT   11    6   12   28   29                                             
CONECT   12   11    5   13   14                                             
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17   27                                                  
CONECT   17   16   18   26                                                  
CONECT   18   17   19   23                                                  
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22   57                                                  
CONECT   22   21                                                            
CONECT   23   18   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   17                                                       
CONECT   27   16                                                            
CONECT   28   11                                                            
CONECT   29   11   30   34                                                  
CONECT   30   29   31                                                       
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31                                                            
CONECT   34   29   35   39                                                  
CONECT   35   34   36                                                       
CONECT   36   35   37   38                                                  
CONECT   37   36                                                            
CONECT   38   36                                                            
CONECT   39   34    4   40   45                                             
CONECT   40   39   41                                                       
CONECT   41   40   42                                                       
CONECT   42   41   43   44                                                  
CONECT   43   42                                                            
CONECT   44   42                                                            
CONECT   45   39   46   50                                                  
CONECT   46   45   47                                                       
CONECT   47   46   48   49                                                  
CONECT   48   47                                                            
CONECT   49   47                                                            
CONECT   50   45   51   55                                                  
CONECT   51   50   52                                                       
CONECT   52   51   53   54                                                  
CONECT   53   52                                                            
CONECT   54   52                                                            
CONECT   55   50    2   56                                                  
CONECT   56   55   57                                                       
CONECT   57   56   21   58                                                  
CONECT   58   57                                                            
MASTER        0    0    0    0    0    0    0    0   58    0  124    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₈H₄₇NO₁₈

Average Mass

805.7830 Da

Monoisotopic Mass

805.27931 Da

IUPAC Name

[(1S,3R,13S,14S,17S,18R,19R,20R,21S,22S,23R,24R,25S)-18,19,21,22,24-pentakis(acetyloxy)-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0^{1,20}.0^{3,23}.0^{7,12}]pentacosa-7(12),8,10-trien-20-yl]methyl acetate

Traditional Name

CAS Registry Number

Not Available

SMILES

[H][C@@]12[C@@H](OC(C)=O)[C@@]34O[C@@]1(C)COC(=O)C1=C(N=CC=C1)[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(COC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@]4(C)O

InChI Identifier

InChI=1S/C38H47NO18/c1-16-17(2)33(46)56-30-28(52-20(5)42)32(55-23(8)45)37(15-49-18(3)40)31(54-22(7)44)27(51-19(4)41)25-29(53-21(6)43)38(37,36(30,10)48)57-35(25,9)14-50-34(47)24-12-11-13-39-26(16)24/h11-13,16-17,25,27-32,48H,14-15H2,1-10H3/t16-,17-,25+,27-,28-,29+,30-,31+,32-,35-,36-,37+,38-/m0/s1

InChI Key

PBFGAFDJVQAMRS-CZQNRJKOSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
COSY NMR	[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kl14ji@163.com	Not Available	Not Available	2023-10-31	View Spectrum
HMBC NMR	[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kl14ji@163.com	Not Available	Not Available	2023-10-31	View Spectrum
HSQC NMR	[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kl14ji@163.com	Not Available	Not Available	2023-10-31	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)	kl14ji@163.com	Not Available	Not Available	2023-10-31	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, CDCl3, experimental)	kl14ji@163.com	Not Available	Not Available	2023-10-31	View Spectrum

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View

Chemical Shift Submissions

Not Available

Species

Species of Origin

Not Available

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	-0.24	ChemAxon
pKa (Strongest Acidic)	12.74	ChemAxon
pKa (Strongest Basic)	2.61	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	252.75 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	182.8 m³·mol⁻¹	ChemAxon
Polarizability	78.92 Å³	ChemAxon
Number of Rings	5	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

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

DOI: 10.1021/acs.jnatprod.3c00504

Showing NP-Card for 8-epi-euonymine (NP0332037)

MOL for NP0332037 (8-epi-euonymine)

3D MOL for NP0332037 (8-epi-euonymine)

3D SDF for NP0332037 (8-epi-euonymine)

3D-SDF for NP0332037 (8-epi-euonymine)

PDB for NP0332037 (8-epi-euonymine)

3D PDB for NP0332037 (8-epi-euonymine)

SMILES for NP0332037 (8-epi-euonymine)

INCHI for NP0332037 (8-epi-euonymine)

Structure for NP0332037 (8-epi-euonymine)

3D Structure for NP0332037 (8-epi-euonymine)