Summary

IMPPAT Phytochemical identifier: IMPHY012192

Phytochemical name: 7-Octen-4-OL

Synonymous chemical names:
7-octen-4-ol

External chemical identifiers:
CID:40923, SureChEMBL:SCHEMBL2474318, MolPort-014-214-154

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Chemical structure information

SMILES:
CCCC(CCC=C)O

InChI:
InChI=1S/C8H16O/c1-3-5-7-8(9)6-4-2/h3,8-9H,1,4-7H2,2H3

InChIKey:
MJWKMORBWQZWOT-UHFFFAOYSA-N

DeepSMILES:
CCCCCCC=C))))O

Functional groups:
C=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: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.84

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Chemical structure download