NP-MRD: Showing NP-Card for 6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one (NP0254099)

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Record Information

Version

2.0

Created at

2022-09-07 18:09:25 UTC

Updated at

2022-09-07 18:09:25 UTC

NP-MRD ID

NP0254099

Secondary Accession Numbers

None

Natural Product Identification

Common Name

6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one

Description

Not Available

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309072220092D          

 54 57  0  0  0  0            999 V2000
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M  END

     RDKit          3D

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 43107  1  1
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 41105  1  1
 42106  1  0
 39103  1  1
 40104  1  0
 37101  1  1
 38102  1  0
 35 99  1  6
 36100  1  0
M  END


  Mrv1652309072220092D          

 54 57  0  0  0  0            999 V2000
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    2.9627    4.1952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3055    4.6840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.5658   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.9947   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4782    1.6455    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
  2  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
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  8 10  2  0  0  0  0
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 21 23  1  0  0  0  0
 18 24  1  0  0  0  0
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 31 39  1  0  0  0  0
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 25 43  1  0  0  0  0
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 14 45  1  0  0  0  0
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 47 48  1  0  0  0  0
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 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 51 52  1  0  0  0  0
 52 53  1  0  0  0  0
 49 53  1  0  0  0  0
 12 53  1  0  0  0  0
 53 54  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0254099

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1OC(OC2C(C)OC(OC(CC=C(C)C)C(\C)=C\C3C(=O)C(C)C4CCCC4(C)C3(O)C\C=C(/C)C(O)CC=C(C)C)C(O)C2O)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C42H68O12/c1-21(2)13-15-30(43)23(5)17-19-42(50)29(32(44)25(7)28-12-11-18-41(28,42)10)20-24(6)31(16-14-22(3)4)53-39-37(49)35(47)38(27(9)52-39)54-40-36(48)34(46)33(45)26(8)51-40/h13-14,17,20,25-31,33-40,43,45-50H,11-12,15-16,18-19H2,1-10H3/b23-17+,24-20+

> <INCHI_KEY>
FESYABODVVRUBU-KSTRTYLUSA-N

> <FORMULA>
C42H68O12

> <MOLECULAR_WEIGHT>
764.994

> <EXACT_MASS>
764.47107763

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_ATOM_COUNT>
122

> <JCHEM_AVERAGE_POLARIZABILITY>
86.01579657535379

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
6-[(1E)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2E)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-octahydro-1H-inden-5-one

> <JCHEM_LOGP>
4.108399300666667

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.372888427162529

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.887695843302136

> <JCHEM_PKA_STRONGEST_BASIC>
-1.4070973118324774

> <JCHEM_POLAR_SURFACE_AREA>
195.6

> <JCHEM_REFRACTIVITY>
205.86780000000007

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
6-[(1E)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2E)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 07-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   07-SEP-22         0                                  
HETATM    1  C   UNK     0       2.034   5.739   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.024   6.919   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.497   8.366   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       4.541   6.651   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.530   7.831   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       7.047   7.564   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       8.037   8.743   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       7.574   6.117   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       9.090   5.849   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.584   4.937   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       7.111   3.490   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       6.121   2.310   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       5.131   3.490   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       7.454   1.540   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       8.788   2.310   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      10.122   1.540   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      10.122  -0.000   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      11.455   2.310   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      11.455   3.850   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      10.122   4.620   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      10.122   6.160   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      11.455   6.930   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       8.788   6.930   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      12.789   1.540   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      12.789  -0.000   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      11.455  -0.770   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      11.455  -2.310   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      10.122  -3.080   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      12.789  -3.080   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0      12.789  -4.620   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0      14.123  -5.390   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0      15.456  -4.620   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0      16.790  -5.390   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      18.124  -4.620   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      16.790  -6.930   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0      18.124  -7.700   0.000  0.00  0.00           O+0
HETATM   37  C   UNK     0      15.456  -7.700   0.000  0.00  0.00           C+0
HETATM   38  O   UNK     0      15.456  -9.240   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0      14.123  -6.930   0.000  0.00  0.00           C+0
HETATM   40  O   UNK     0      12.789  -7.700   0.000  0.00  0.00           O+0
HETATM   41  C   UNK     0      14.123  -2.310   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0      15.456  -3.080   0.000  0.00  0.00           O+0
HETATM   43  C   UNK     0      14.123  -0.770   0.000  0.00  0.00           C+0
HETATM   44  O   UNK     0      15.456  -0.000   0.000  0.00  0.00           O+0
HETATM   45  C   UNK     0       7.454   0.000   0.000  0.00  0.00           C+0
HETATM   46  O   UNK     0       8.788  -0.770   0.000  0.00  0.00           O+0
HETATM   47  C   UNK     0       6.121  -0.770   0.000  0.00  0.00           C+0
HETATM   48  C   UNK     0       6.121  -2.310   0.000  0.00  0.00           C+0
HETATM   49  C   UNK     0       4.787   0.000   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0       3.322  -0.476   0.000  0.00  0.00           C+0
HETATM   51  C   UNK     0       2.417   0.770   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0       3.322   2.016   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0       4.787   1.540   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0       4.626   3.072   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6                                                            
CONECT    8    6    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14   53                                             
CONECT   13   12                                                            
CONECT   14   12   15   45                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19   24                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22   23                                                  
CONECT   22   21                                                            
CONECT   23   21                                                            
CONECT   24   18   25                                                       
CONECT   25   24   26   43                                                  
CONECT   26   25   27                                                       
CONECT   27   26   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27   30   41                                                  
CONECT   30   29   31                                                       
CONECT   31   30   32   39                                                  
CONECT   32   31   33                                                       
CONECT   33   32   34   35                                                  
CONECT   34   33                                                            
CONECT   35   33   36   37                                                  
CONECT   36   35                                                            
CONECT   37   35   38   39                                                  
CONECT   38   37                                                            
CONECT   39   37   31   40                                                  
CONECT   40   39                                                            
CONECT   41   29   42   43                                                  
CONECT   42   41                                                            
CONECT   43   41   25   44                                                  
CONECT   44   43                                                            
CONECT   45   14   46   47                                                  
CONECT   46   45                                                            
CONECT   47   45   48   49                                                  
CONECT   48   47                                                            
CONECT   49   47   50   53                                                  
CONECT   50   49   51                                                       
CONECT   51   50   52                                                       
CONECT   52   51   53                                                       
CONECT   53   52   49   12   54                                             
CONECT   54   53                                                            
MASTER        0    0    0    0    0    0    0    0   54    0  114    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₂H₆₈O₁₂

Average Mass

764.9940 Da

Monoisotopic Mass

764.47108 Da

IUPAC Name

6-[(1E)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2E)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-octahydro-1H-inden-5-one

Traditional Name

CAS Registry Number

Not Available

SMILES

CC1OC(OC2C(C)OC(OC(CC=C(C)C)C(\C)=C\C3C(=O)C(C)C4CCCC4(C)C3(O)C\C=C(/C)C(O)CC=C(C)C)C(O)C2O)C(O)C(O)C1O

InChI Identifier

InChI=1S/C42H68O12/c1-21(2)13-15-30(43)23(5)17-19-42(50)29(32(44)25(7)28-12-11-18-41(28,42)10)20-24(6)31(16-14-22(3)4)53-39-37(49)35(47)38(27(9)52-39)54-40-36(48)34(46)33(45)26(8)51-40/h13-14,17,20,25-31,33-40,43,45-50H,11-12,15-16,18-19H2,1-10H3/b23-17+,24-20+

InChI Key

FESYABODVVRUBU-KSTRTYLUSA-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

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	4.11	ChemAxon
pKa (Strongest Acidic)	11.89	ChemAxon
pKa (Strongest Basic)	-1.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	195.6 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	205.87 m³·mol⁻¹	ChemAxon
Polarizability	86.02 Å³	ChemAxon
Number of Rings	4	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 6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one (NP0254099)

MOL for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

3D MOL for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

3D SDF for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

3D-SDF for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

PDB for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

3D PDB for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

SMILES for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

INCHI for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

Structure for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)

3D Structure for NP0254099 (6-[(1e)-3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,6-dimethylhepta-1,5-dien-1-yl]-7-hydroxy-7-[(2e)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-4,7a-dimethyl-hexahydroinden-5-one)