Summary

IMPPAT Phytochemical identifier: IMPHY011386

Phytochemical name: 8(12)-Drimene

Synonymous chemical names:
8(12)-drimene, drim-8(12)-ene

External chemical identifiers:
CID:12184338, ChEMBL:CHEMBL507971, ZINC:ZINC000042834626

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Chemical structure information

SMILES:
C=C1CC[C@@H]2[C@]([C@H]1C)(C)CCCC2(C)C

InChI:
InChI=1S/C15H26/c1-11-7-8-13-14(3,4)9-6-10-15(13,5)12(11)2/h12-13H,1,6-10H2,2-5H3/t12-,13-,15+/m0/s1

InChIKey:
WOBFHHHYXAFVKB-KCQAQPDRSA-N

DeepSMILES:
C=CCC[C@@H][C@][C@H]6C))C)CCCC6C)C

Functional groups:
C=C(C)C

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1CCC2CCCCC2C1

Scaffold Graph/Node level:
CC1CCC2CCCCC2C1

Scaffold Graph level:
CC1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Branched unsaturated hydrocarbons

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Drimane sesquiterpenoids

NP-Likeness score: 3.201

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Chemical structure download