Summary

IMPPAT Phytochemical identifier: IMPHY017640

Phytochemical name: (8Z,11Z,14Z)-Heptadecatrienal

Synonymous chemical names:
(z,z,z)-heptadeca-8,11,14-trienal

External chemical identifiers:
CID:6430107, ChEBI:76151, ZINC:ZINC000030730664

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Chemical structure information

SMILES:
CC/C=CC/C=CC/C=CCCCCCCC=O

InChI:
InChI=1S/C17H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h3-4,6-7,9-10,17H,2,5,8,11-16H2,1H3/b4-3-,7-6-,10-9-

InChIKey:
NIPNNUONNZABRE-PDBXOOCHSA-N

DeepSMILES:
CC/C=CC/C=CC/C=CCCCCCCC=O

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

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty aldehydes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty aldehydes

NP-Likeness score: 1.645

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Chemical structure download