Summary

IMPPAT Phytochemical identifier: IMPHY016335

Phytochemical name: 3,5,7-Octatrien-2-ol, 2,6-dimethyl-

Synonymous chemical names:
2,6-dimethyl-3,5,7-octatrien,2-ol, 2,6-dimethyl-3,5,7-octatrien-2 oil

External chemical identifiers:
CID:538933

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Chemical structure information

SMILES:
C=CC(=CC=CC(O)(C)C)C

InChI:
InChI=1S/C10H16O/c1-5-9(2)7-6-8-10(3,4)11/h5-8,11H,1H2,2-4H3

InChIKey:
HYBLHNGOEIJQDA-UHFFFAOYSA-N

DeepSMILES:
C=CC=CC=CCO)C)C)))))C

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

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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: Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids

NP-Likeness score: 3.116

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Chemical structure download