Summary

IMPPAT Phytochemical identifier: IMPHY006263

Phytochemical name: Falcarinolone

Synonymous chemical names:
falcarinol-one, falcarinolone

External chemical identifiers:
CID:6442185, ChEBI:173841

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Chemical structure information

SMILES:
CCCCCCC/C=CC(C#CC#CC(=O)C=C)O

InChI:
InChI=1S/C17H22O2/c1-3-5-6-7-8-9-10-14-17(19)15-12-11-13-16(18)4-2/h4,10,14,17,19H,2-3,5-9H2,1H3/b14-10-

InChIKey:
STNWZOBISHHDCD-UVTDQMKNSA-N

DeepSMILES:
CCCCCCC/C=CCC#CC#CC=O)C=C)))))))O

Functional groups:
C/C=CC, C=CC(=O)C#CC#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: 2.728

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Chemical structure download