Summary

IMPPAT Phytochemical identifier: IMPHY016173

Phytochemical name: 1,2,5,5,8a-Pentamethyl-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-ol

Synonymous chemical names:
1,2,5,5,8a-pentamethyl-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-ol

External chemical identifiers:
CID:585258

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Chemical structure information

SMILES:
CC1CC=C2C(C1(C)O)(C)CCCC2(C)C

InChI:
InChI=1S/C15H26O/c1-11-7-8-12-13(2,3)9-6-10-14(12,4)15(11,5)16/h8,11,16H,6-7,9-10H2,1-5H3

InChIKey:
GKVOSYCVNKHQSI-UHFFFAOYSA-N

DeepSMILES:
CCCC=CCC6C)O))C)CCCC6C)C

Functional groups:
CC=C(C)C, CO

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=C2CCCCC2CCC1

Scaffold Graph/Node level:
C1CCC2CCCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP-Likeness score: 2.413

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Chemical structure download