Summary

IMPPAT Phytochemical identifier: IMPHY017129

Phytochemical name: Oct-1-EN-2-OL

Synonymous chemical names:
1-octen-2-ol

External chemical identifiers:
CID:15372159, SureChEMBL:SCHEMBL49642

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Chemical structure information

SMILES:
CCCCCCC(=C)O

InChI:
InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h9H,2-7H2,1H3

InChIKey:
LNGYMCOWZUPVOA-UHFFFAOYSA-N

DeepSMILES:
CCCCCCC=C)O

Functional groups:
C=C(C)O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Enols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.365

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Chemical structure download