Summary

IMPPAT Phytochemical identifier: IMPHY016210

Phytochemical name: 17-Octadecenal

Synonymous chemical names:
17-octadecenal

External chemical identifiers:
CID:41922

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Chemical structure information

SMILES:
C=CCCCCCCCCCCCCCCCC=O

InChI:
InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2,18H,1,3-17H2

InChIKey:
MXCKZUNSOZSBPA-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCCCCCCCCCCCC=O

Functional groups:
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: 0.831

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Chemical structure download