Summary

IMPPAT Phytochemical identifier: IMPHY017409

Phytochemical name: 2,7-Octadien-1-OL

Synonymous chemical names:
2,7-octadien-1-ol

External chemical identifiers:
CID:5365650, ZINC:ZINC000002015051, SureChEMBL:SCHEMBL514948

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Chemical structure information

SMILES:
OC/C=C/CCCC=C

InChI:
InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h2,6-7,9H,1,3-5,8H2/b7-6+

InChIKey:
YHYGSIBXYYKYFB-VOTSOKGWSA-N

DeepSMILES:
OC/C=C/CCCC=C

Functional groups:
C/C=C/C, C=CC, CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 2.476

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Chemical structure download