Summary

IMPPAT Phytochemical identifier: IMPHY016067

Phytochemical name: cis-8-Undecen-1-al

Synonymous chemical names:
(8z)-undecenal

External chemical identifiers:
CID:6436710, ZINC:ZINC000005019197, FDASRS:U4OQ6978QW, SureChEMBL:SCHEMBL3506004

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Chemical structure information

SMILES:
CC/C=CCCCCCCC=O

InChI:
InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h3-4,11H,2,5-10H2,1H3/b4-3-

InChIKey:
DWQXOILNGUCNSH-ARJAWSKDSA-N

DeepSMILES:
CC/C=CCCCCCCC=O

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

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbonyl compounds

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty aldehydes

NP-Likeness score: 1.939

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Chemical structure download