NP-MRD: Showing NP-Card for (1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate (NP0317760)

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Record Information

Version

2.0

Created at

2022-09-11 17:49:30 UTC

Updated at

2022-09-11 17:49:31 UTC

NP-MRD ID

NP0317760

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate

Description

(1R,3S,5R,6aR,7S,8S,10R,10aS)-3,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6aH,7H,8H,9H,10H-naphtho[4,4a-c]furan-1-yl acetate belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations. (1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate is found in Casearia lucida. Based on a literature review very few articles have been published on (1R,3S,5R,6aR,7S,8S,10R,10aS)-3,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6aH,7H,8H,9H,10H-naphtho[4,4a-c]furan-1-yl acetate.

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309112219492D          

 35 37  0  0  1  0            999 V2000
    3.2487    0.1006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9292   -0.3659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6838   -0.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5082    0.8012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4943   -0.2638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3293   -0.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2496   -0.1962    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.7450   -0.8998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4404    0.6064    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8806    1.2715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2310    0.8424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7083    0.4745    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.6343    0.8262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0600    1.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6397   -0.5269    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.2394   -1.0935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0485   -1.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2580   -2.1321    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.1130   -2.9996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5666   -3.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3908   -3.6752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1857   -4.4432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6583   -1.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8492   -0.7628    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.9636   -0.6983    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.7622   -1.1195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5912   -0.8492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7619   -0.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2049   -1.4006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8115    0.1126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9933    0.2185    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.8113    1.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1530    1.9709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6589    2.6316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9722    2.0685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  7  6  1  1  0  0  0
  7  8  1  6  0  0  0
  7  9  1  0  0  0  0
  9 10  1  1  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  1  0  0  0
 13 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  1  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  6  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 18 23  1  0  0  0  0
 24 23  1  6  0  0  0
  7 24  1  0  0  0  0
 15 24  1  0  0  0  0
 16 25  1  0  0  0  0
 25 26  1  1  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
 25 30  1  0  0  0  0
 30 31  1  0  0  0  0
 15 31  1  0  0  0  0
 31 32  1  1  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  2  0  0  0  0
M  END


  Mrv1652309112219492D          

 35 37  0  0  1  0            999 V2000
    3.2487    0.1006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9292   -0.3659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6838   -0.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5082    0.8012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4943   -0.2638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3293   -0.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2496   -0.1962    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.7450   -0.8998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4404    0.6064    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8806    1.2715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2310    0.8424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7083    0.4745    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.6343    0.8262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0600    1.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6397   -0.5269    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.2394   -1.0935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0485   -1.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2580   -2.1321    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.1130   -2.9996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5666   -3.7113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3908   -3.6752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1857   -4.4432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6583   -1.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8492   -0.7628    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.9636   -0.6983    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.7622   -1.1195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5912   -0.8492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7619   -0.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2049   -1.4006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8115    0.1126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9933    0.2185    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.8113    1.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1530    1.9709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6589    2.6316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9722    2.0685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  7  6  1  1  0  0  0
  7  8  1  6  0  0  0
  7  9  1  0  0  0  0
  9 10  1  1  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  1  0  0  0
 13 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  1  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  6  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 18 23  1  0  0  0  0
 24 23  1  6  0  0  0
  7 24  1  0  0  0  0
 15 24  1  0  0  0  0
 16 25  1  0  0  0  0
 25 26  1  1  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
 25 30  1  0  0  0  0
 30 31  1  0  0  0  0
 15 31  1  0  0  0  0
 31 32  1  1  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0317760

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CO[C@@H]1C[C@H](C)[C@](C)(CCC(=C)C=C)[C@H]2C[C@@H](OC(C)=O)C=C3[C@H](OC(C)=O)O[C@H](OC(C)=O)[C@@]123

> <INCHI_IDENTIFIER>
InChI=1S/C27H38O8/c1-9-15(2)10-11-26(7)16(3)12-23(31-8)27-21(13-20(14-22(26)27)32-17(4)28)24(33-18(5)29)35-25(27)34-19(6)30/h9,13,16,20,22-25H,1-2,10-12,14H2,3-8H3/t16-,20-,22+,23+,24+,25-,26-,27+/m0/s1

> <INCHI_KEY>
BZVDIOLNPIHYMD-WKBHZGDZSA-N

> <FORMULA>
C27H38O8

> <MOLECULAR_WEIGHT>
490.593

> <EXACT_MASS>
490.256668184

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
73

> <JCHEM_AVERAGE_POLARIZABILITY>
52.92533553046841

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1R,3S,5R,6aR,7S,8S,10R,10aS)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6aH,7H,8H,9H,10H-naphtho[1,8a-c]furan-3-yl acetate

> <JCHEM_LOGP>
3.512687592999998

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-3.9901195108419247

> <JCHEM_POLAR_SURFACE_AREA>
97.36000000000001

> <JCHEM_REFRACTIVITY>
127.65899999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(1R,3S,5R,6aR,7S,8S,10R,10aS)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6aH,8H,9H,10H-naphtho[1,8a-c]furan-3-yl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-22         0                                  
HETATM    1  C   UNK     0       6.064   0.188   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       7.334  -0.683   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       8.743  -0.009   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       8.415   1.495   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      10.256  -0.492   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      11.815  -0.009   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      13.533  -0.366   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      12.591  -1.680   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      13.889   1.132   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      12.844   2.373   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      15.364   1.572   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      16.255   0.886   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      17.984   1.542   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0      18.779   3.043   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      16.127  -0.983   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      17.247  -2.041   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      16.890  -3.539   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      15.415  -3.980   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      15.144  -5.599   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0      15.991  -6.928   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      17.529  -6.860   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      15.280  -8.294   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0      14.296  -2.922   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      14.652  -1.424   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      18.599  -1.303   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      20.089  -2.090   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      21.637  -1.585   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      21.956  -0.078   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      22.782  -2.614   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0      18.315   0.210   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0      16.788   0.408   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0      16.448   2.191   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0      17.086   3.679   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      16.163   4.912   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      18.615   3.861   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                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8    9   24                                             
CONECT    8    7                                                            
CONECT    9    7   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9   12                                                       
CONECT   12   11   13   15                                                  
CONECT   13   12   14                                                       
CONECT   14   13                                                            
CONECT   15   12   16   24   31                                             
CONECT   16   15   17   25                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   23                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20                                                            
CONECT   23   18   24                                                       
CONECT   24   23    7   15                                                  
CONECT   25   16   26   30                                                  
CONECT   26   25   27                                                       
CONECT   27   26   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27                                                            
CONECT   30   25   31                                                       
CONECT   31   30   15   32                                                  
CONECT   32   31   33                                                       
CONECT   33   32   34   35                                                  
CONECT   34   33                                                            
CONECT   35   33                                                            
MASTER        0    0    0    0    0    0    0    0   35    0   74    0
END

View in JSmol

Synonyms

Value	Source
(1R,3S,5R,6AR,7S,8S,10R,10as)-3,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6ah,7H,8H,9H,10H-naphtho[4,4a-c]furan-1-yl acetic acid	Generator

Chemical Formula

C₂₇H₃₈O₈

Average Mass

490.5930 Da

Monoisotopic Mass

490.25667 Da

IUPAC Name

(1R,3S,5R,6aR,7S,8S,10R,10aS)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6aH,7H,8H,9H,10H-naphtho[1,8a-c]furan-3-yl acetate

Traditional Name

(1R,3S,5R,6aR,7S,8S,10R,10aS)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1H,3H,5H,6H,6aH,8H,9H,10H-naphtho[1,8a-c]furan-3-yl acetate

CAS Registry Number

Not Available

SMILES

CO[C@@H]1C[C@H](C)[C@](C)(CCC(=C)C=C)[C@H]2C[C@@H](OC(C)=O)C=C3[C@H](OC(C)=O)O[C@H](OC(C)=O)[C@@]123

InChI Identifier

InChI=1S/C27H38O8/c1-9-15(2)10-11-26(7)16(3)12-23(31-8)27-21(13-20(14-22(26)27)32-17(4)28)24(33-18(5)29)35-25(27)34-19(6)30/h9,13,16,20,22-25H,1-2,10-12,14H2,3-8H3/t16-,20-,22+,23+,24+,25-,26-,27+/m0/s1

InChI Key

BZVDIOLNPIHYMD-WKBHZGDZSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Casearia lucida	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Diterpenoids

Direct Parent

Colensane and clerodane diterpenoids

Alternative Parents

Substituents

Clerodane diterpenoid
Naphthofuran
Tricarboxylic acid or derivatives
Tetrahydrofuran
Carboxylic acid ester
Oxacycle
Organoheterocyclic compound
Ether
Dialkyl ether
Carboxylic acid derivative
Acetal
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic compounds

External Descriptors

Not Available

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	3.51	ChemAxon
pKa (Strongest Basic)	-4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	97.36 Å²	ChemAxon
Rotatable Bond Count	11	ChemAxon
Refractivity	127.66 m³·mol⁻¹	ChemAxon
Polarizability	52.93 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	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

9224417

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

11049250

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for (1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate (NP0317760)

MOL for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

3D MOL for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

3D SDF for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

3D-SDF for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

PDB for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

3D PDB for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

SMILES for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

INCHI for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

Structure for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)

3D Structure for NP0317760 ((1r,3s,5r,6ar,7s,8s,10r,10as)-1,5-bis(acetyloxy)-10-methoxy-7,8-dimethyl-7-(3-methylidenepent-4-en-1-yl)-1h,3h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-3-yl acetate)