NP-MRD: Showing NP-Card for (1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione (NP0221490)

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Record Information

Version

2.0

Created at

2022-09-05 23:05:00 UTC

Updated at

2022-09-05 23:05:00 UTC

NP-MRD ID

NP0221490

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione

Description

(1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione is found in Hypericum prolificum.

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309062201052D          

 35 36  0  0  1  0            999 V2000
    0.1045    3.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8190    3.1937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8190    2.3687    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1045    1.9562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5335    1.9562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2479    2.3687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5335    1.1312    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.7713    0.8155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1879    1.3989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4555    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7713   -0.7089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1879   -1.2923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5335   -1.0246    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.2957   -0.7089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6114    0.0533    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4364    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8489   -0.6612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6739   -0.6612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0864   -1.3757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0864    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2957    0.8155    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0769    1.0807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5608    1.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3700    1.7577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9140    1.1374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7231    1.2983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9883    2.0796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2671    0.6781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0762    0.8390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3414    1.6202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1505    1.7812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4157    2.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6945    1.1609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8029    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4704    0.5382    0.0000 O   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  1  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  7  5  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  1  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 15 21  1  0  0  0  0
  7 21  1  0  0  0  0
 21 22  1  1  0  0  0
 21 23  1  6  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 13 34  1  6  0  0  0
  7 34  1  0  0  0  0
 34 35  2  0  0  0  0
M  END


  Mrv1652309062201052D          

 35 36  0  0  1  0            999 V2000
    0.1045    3.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8190    3.1937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8190    2.3687    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1045    1.9562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5335    1.9562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2479    2.3687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5335    1.1312    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.7713    0.8155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1879    1.3989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4555    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7713   -0.7089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1879   -1.2923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5335   -1.0246    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.2957   -0.7089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6114    0.0533    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4364    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8489   -0.6612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6739   -0.6612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0864   -1.3757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0864    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2957    0.8155    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0769    1.0807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5608    1.5967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3700    1.7577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9140    1.1374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7231    1.2983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9883    2.0796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2671    0.6781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0762    0.8390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3414    1.6202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1505    1.7812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4157    2.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6945    1.1609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8029    0.0533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4704    0.5382    0.0000 O   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  1  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  7  5  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  1  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 15 21  1  0  0  0  0
  7 21  1  0  0  0  0
 21 22  1  1  0  0  0
 21 23  1  6  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 13 34  1  6  0  0  0
  7 34  1  0  0  0  0
 34 35  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0221490

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC[C@H](C)C(=O)[C@]12C(=O)C=C(O)[C@H](C[C@H](CC=C(C)C)[C@@]1(C)CC\C=C(/C)CCC=C(C)C)C2=O

> <INCHI_IDENTIFIER>
InChI=1S/C31H46O4/c1-9-23(7)28(34)31-27(33)19-26(32)25(29(31)35)18-24(16-15-21(4)5)30(31,8)17-11-14-22(6)13-10-12-20(2)3/h12,14-15,19,23-25,32H,9-11,13,16-18H2,1-8H3/b22-14+/t23-,24-,25-,30+,31-/m0/s1

> <INCHI_KEY>
PBOGLNZYQKLFOG-XVSHDCQBSA-N

> <FORMULA>
C31H46O4

> <MOLECULAR_WEIGHT>
482.705

> <EXACT_MASS>
482.339609961

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
81

> <JCHEM_AVERAGE_POLARIZABILITY>
57.3358178956169

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1S,5S,7S,8R)-8-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2S)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione

> <JCHEM_LOGP>
8.388785499666668

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
14.919348332950097

> <JCHEM_PKA_STRONGEST_ACIDIC>
5.025007136457992

> <JCHEM_PKA_STRONGEST_BASIC>
-6.748480139202489

> <JCHEM_POLAR_SURFACE_AREA>
71.44

> <JCHEM_REFRACTIVITY>
147.82480000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(1S,5S,7S,8R)-8-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2S)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-SEP-22         0                                  
HETATM    1  C   UNK     0       0.195   6.732   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.529   5.962   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       1.529   4.422   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.195   3.652   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.862   3.652   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       4.196   4.422   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       2.862   2.112   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.440   1.522   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       0.351   2.611   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       0.850   0.099   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.440  -1.323   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       0.351  -2.412   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       2.862  -1.913   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.285  -1.323   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       4.875   0.099   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.415   0.099   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       7.185  -1.234   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       8.725  -1.234   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       9.495  -2.568   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       9.495   0.099   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       4.285   1.522   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       5.744   2.017   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       4.780   2.981   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       6.291   3.281   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       7.306   2.123   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       8.816   2.424   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       9.311   3.882   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       9.832   1.266   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      11.342   1.566   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      11.837   3.024   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      13.348   3.325   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      13.843   4.783   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      14.363   2.167   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       3.365   0.099   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0       4.611   1.005   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8   21   34                                             
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11                                                       
CONECT   11   10   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11   14   34                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   21                                                  
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18                                                            
CONECT   21   15    7   22   23                                             
CONECT   22   21                                                            
CONECT   23   21   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26   29                                                       
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31                                                            
CONECT   34   13    7   35                                                  
CONECT   35   34                                                            
MASTER        0    0    0    0    0    0    0    0   35    0   72    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₁H₄₆O₄

Average Mass

482.7050 Da

Monoisotopic Mass

482.33961 Da

IUPAC Name

(1S,5S,7S,8R)-8-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2S)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione

Traditional Name

(1S,5S,7S,8R)-8-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2S)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione

CAS Registry Number

Not Available

SMILES

CC[C@H](C)C(=O)[C@]12C(=O)C=C(O)[C@H](C[C@H](CC=C(C)C)[C@@]1(C)CC\C=C(/C)CCC=C(C)C)C2=O

InChI Identifier

InChI=1S/C31H46O4/c1-9-23(7)28(34)31-27(33)19-26(32)25(29(31)35)18-24(16-15-21(4)5)30(31,8)17-11-14-22(6)13-10-12-20(2)3/h12,14-15,19,23-25,32H,9-11,13,16-18H2,1-8H3/b22-14+/t23-,24-,25-,30+,31-/m0/s1

InChI Key

PBOGLNZYQKLFOG-XVSHDCQBSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Hypericum prolificum	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	8.39	ChemAxon
pKa (Strongest Acidic)	5.03	ChemAxon
pKa (Strongest Basic)	-6.7	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	71.44 Å²	ChemAxon
Rotatable Bond Count	11	ChemAxon
Refractivity	147.82 m³·mol⁻¹	ChemAxon
Polarizability	57.34 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

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References

General References

LOTUS database [Link]

Showing NP-Card for (1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione (NP0221490)

MOL for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

3D MOL for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

3D SDF for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

3D-SDF for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

PDB for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

3D PDB for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

SMILES for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

INCHI for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

Structure for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)

3D Structure for NP0221490 ((1s,5s,7s,8r)-8-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-8-methyl-7-(3-methylbut-2-en-1-yl)-1-[(2s)-2-methylbutanoyl]bicyclo[3.3.1]non-3-ene-2,9-dione)