NP-MRD: Showing NP-Card for [(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol (NP0260800)

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Record Information

Version

2.0

Created at

2022-09-08 03:03:53 UTC

Updated at

2022-09-08 03:03:53 UTC

NP-MRD ID

NP0260800

Secondary Accession Numbers

None

Natural Product Identification

Common Name

[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol

Description

(+)-Albicanol belongs to the class of organic compounds known as primary alcohols. Primary alcohols are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl) (+)-albicanol is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. [(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol is found in Bazzania japonica, Cadlina luteomarginata, Cryptoporus volvatus, Cylindrocolea recurvifolia, Diplophyllum albicans, Dryopteris fragrans, Frullania monocera, Hedychium spicatum, Loxodonta africana and Porella navicularis. [(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol was first documented in 2020 (PMID: 32858988). Based on a literature review a small amount of articles have been published on (+)-albicanol (PMID: 35143987) (PMID: 34856373) (PMID: 33761044) (PMID: 33502412).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 42 43  0  0  0  0  0  0  0  0999 V2000
    3.3874    0.8037   -0.9691 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2239    0.9092   -0.3629 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3226    2.0746   -0.6670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0939    1.6651   -0.8815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5517    0.6206    0.1467 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.9797    0.3020    0.0484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6570    1.0935   -1.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7222    0.8164    1.2961 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3505   -1.1195   -0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4771   -2.1464    0.4118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1572   -1.6783    0.9205 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3848   -0.5667    0.0993 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6375   -1.0482   -1.3140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7071   -0.0588    0.6295 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.6603   -1.1135    1.0347 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8200   -0.4733    1.4974 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6966    1.5436   -1.6774 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0574   -0.0140   -0.7793 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3780    2.7494    0.2122 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6847    2.5615   -1.5949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3051    1.3680   -1.9048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7289    2.5730   -0.6595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3345    1.1230    1.1379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7245    0.7207   -1.0693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7154    2.1604   -0.8610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2641    0.8265   -2.0649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2051    1.7824    1.5432 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7625    1.0685    1.0696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5774    0.1561    2.1484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3885   -1.2589    0.2566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5104   -1.3138   -1.2759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9755   -2.6974    1.2648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2896   -2.9650   -0.3461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2203   -1.4067    1.9940 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5596   -2.5296    0.8672 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9586   -0.2294   -1.9927 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5411   -1.7230   -1.2418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1803   -1.6634   -1.7158 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4540    0.5417    1.5480 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2419   -1.6322    1.9288 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9267   -1.8307    0.2496 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5291    0.0087    2.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
  7  6  1  0
  6  8  1  0
  6  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  6
 12 14  1  0
 14 15  1  0
 15 16  1  0
 14  2  1  0
  2  1  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  5 12  1  0
  7 24  1  0
  7 25  1  0
  7 26  1  0
  8 27  1  0
  8 28  1  0
  8 29  1  0
  9 30  1  0
  9 31  1  0
 10 32  1  0
 10 33  1  0
 11 34  1  0
 11 35  1  0
 13 36  1  0
 13 37  1  0
 13 38  1  0
 14 39  1  1
 15 40  1  0
 15 41  1  0
 16 42  1  0
  1 17  1  0
  1 18  1  0
  3 19  1  0
  3 20  1  0
  4 21  1  0
  4 22  1  0
  5 23  1  1
M  END


  Mrv1652309082205032D          

 16 17  0  0  1  0            999 V2000
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3276    0.6320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3882    0.6320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1434   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -2.8875    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  1  0  0  0  0
  5  4  1  1  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  5 12  1  0  0  0  0
 12 13  1  1  0  0  0
 12 14  1  0  0  0  0
  2 14  1  0  0  0  0
 14 15  1  1  0  0  0
 15 16  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0260800

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1(C)CCC[C@]2(C)[C@@H](CO)C(=C)CC[C@@H]12

> <INCHI_IDENTIFIER>
InChI=1S/C15H26O/c1-11-6-7-13-14(2,3)8-5-9-15(13,4)12(11)10-16/h12-13,16H,1,5-10H2,2-4H3/t12-,13-,15+/m0/s1

> <INCHI_KEY>
ZPTSRWNMMWXEHX-KCQAQPDRSA-N

> <FORMULA>
C15H26O

> <MOLECULAR_WEIGHT>
222.372

> <EXACT_MASS>
222.198365457

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
42

> <JCHEM_AVERAGE_POLARIZABILITY>
27.316047447235622

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-decahydronaphthalen-1-yl]methanol

> <JCHEM_LOGP>
3.4216424413333333

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
18.551131033667286

> <JCHEM_PKA_STRONGEST_BASIC>
-1.2455352858739293

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
68.3282

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-hexahydro-1H-naphthalen-1-yl]methanol

> <JCHEM_VEBER_RULE>
1

$$$$

HEADER    PROTEIN                                 08-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   08-SEP-22         0                                  
HETATM    1  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       4.345   1.180   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       6.325   1.180   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.668  -2.310   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.001  -3.850   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       2.667  -4.620   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       1.334  -5.390   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   14                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   12                                                  
CONECT    6    5    7    8    9                                             
CONECT    7    6                                                            
CONECT    8    6                                                            
CONECT    9    6   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11    5   13   14                                             
CONECT   13   12                                                            
CONECT   14   12    2   15                                                  
CONECT   15   14   16                                                       
CONECT   16   15                                                            
MASTER        0    0    0    0    0    0    0    0   16    0   34    0
END

View in JSmol

Synonyms

Value	Source
(1S,4Aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1-methanol	ChEBI
(4Aalpha)-2-methylene-5,5,8abeta-trimethyldecalin-1beta-methanol	ChEBI
(4Aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1beta-methanol	ChEBI
(8AS)-albicanol	ChEBI
Albicanol	ChEBI
(4Aalpha)-2-methylene-5,5,8abeta-trimethyldecalin-1b-methanol	Generator
(4Aalpha)-2-methylene-5,5,8abeta-trimethyldecalin-1β-methanol	Generator
(4Aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1b-methanol	Generator
(4Aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1β-methanol	Generator

Chemical Formula

C₁₅H₂₆O

Average Mass

222.3720 Da

Monoisotopic Mass

222.19837 Da

IUPAC Name

[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-decahydronaphthalen-1-yl]methanol

Traditional Name

[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-hexahydro-1H-naphthalen-1-yl]methanol

CAS Registry Number

Not Available

SMILES

CC1(C)CCC[C@]2(C)[C@@H](CO)C(=C)CC[C@@H]12

InChI Identifier

InChI=1S/C15H26O/c1-11-6-7-13-14(2,3)8-5-9-15(13,4)12(11)10-16/h12-13,16H,1,5-10H2,2-4H3/t12-,13-,15+/m0/s1

InChI Key

ZPTSRWNMMWXEHX-KCQAQPDRSA-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
Bazzania japonica	LOTUS Database	35616633
Cadlina luteomarginata	LOTUS Database	35616633
Cryptoporus volvatus	LOTUS Database	35616633
Cylindrocolea recurvifolia	LOTUS Database	35616633
Diplophyllum albicans	LOTUS Database	35616633
Dryopteris fragrans	LOTUS Database	35616633
Frullania monocera	LOTUS Database	35616633
Hedychium spicatum	LOTUS Database	35616633
Loxodonta africana	LOTUS Database	35616633
Porella navicularis	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as primary alcohols. Primary alcohols are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Alcohols and polyols

Direct Parent

Primary alcohols

Alternative Parents

Hydrocarbon derivatives

Substituents

Hydrocarbon derivative
Primary alcohol
Aliphatic homopolycyclic compound

Molecular Framework

Aliphatic homopolycyclic 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	3.42	ChemAxon
pKa (Strongest Acidic)	18.55	ChemAxon
pKa (Strongest Basic)	-1.2	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	1	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	20.23 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	68.33 m³·mol⁻¹	ChemAxon
Polarizability	27.32 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	Yes	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00020283

Chemspider ID

149808

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

171360

PDB ID

Not Available

ChEBI ID

155904

Good Scents ID

rw1567351

References

General References

Rosales Martinez A, Enriquez L, Jaraiz M, Pozo Morales L, Rodriguez-Garcia I, Diaz Ojeda E: A Concise Route for the Synthesis of Tetracyclic Meroterpenoids: (+/-)-Aureol Preparation and Mechanistic Interpretation. Mar Drugs. 2020 Aug 26;18(9). pii: md18090441. doi: 10.3390/md18090441. [PubMed:32858988 ]
Lihui X, Xiaojie Q, Hao Y, Jialiang C, Jinming G, Ying C: Albicanol modulates oxidative stress and the p53 axis to suppress profenofos induced genotoxicity in grass carp hepatocytes. Fish Shellfish Immunol. 2022 Mar;122:325-333. doi: 10.1016/j.fsi.2022.02.002. Epub 2022 Feb 8. [PubMed:35143987 ]
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LOTUS database [Link]

Showing NP-Card for [(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol (NP0260800)

MOL for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

3D MOL for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

3D SDF for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

3D-SDF for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

PDB for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

3D PDB for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

SMILES for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

INCHI for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

Structure for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)

3D Structure for NP0260800 ([(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methanol)