Summary

IMPPAT Phytochemical identifier: IMPHY016816

Phytochemical name: Peucelinendiol

Synonymous chemical names:
peucelinendiol

External chemical identifiers:
CID:5366107

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Chemical structure information

SMILES:
OCC(C(CCC=C(C)C)(O)C)C/C=C(/CCC=C(C)C)C

InChI:
InChI=1S/C20H36O2/c1-16(2)9-7-11-18(5)12-13-19(15-21)20(6,22)14-8-10-17(3)4/h9-10,12,19,21-22H,7-8,11,13-15H2,1-6H3/b18-12+

InChIKey:
OAKVKJQFXGOQPH-LDADJPATSA-N

DeepSMILES:
OCCCCCC=CC)C)))))O)C))C/C=C/CCC=CC)C)))))C

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

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids, Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids, Farnesane sesquiterpenoids

NP-Likeness score: 2.014

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Chemical structure download