Summary

IMPPAT Phytochemical identifier: IMPHY017949

Phytochemical name: (2E,5e)-3,7-dimethyl-2,5-octadien-1,7-diol

Synonymous chemical names:
(2e,5e)-3,7-dimethyl-2,5-octadien-1,7-diol

Chemical structure information

SMILES:
OC/C=C(/C/C=C/C(O)(C)C)C

InChI:
InChI=1S/C10H18O2/c1-9(6-8-11)5-4-7-10(2,3)12/h4,6-7,11-12H,5,8H2,1-3H3/b7-4+,9-6+

InChIKey:
RIEVYMMWQZWVIF-KRHXFINASA-N

DeepSMILES:
OC/C=C/C/C=C/CO)C)C)))))C

Functional groups:
C/C=C(C)C, C/C=C/C, 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: Terpenoids

NP Classifier Superclass: Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids

NP-Likeness score: 3.315

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Chemical structure download