Summary

IMPPAT Phytochemical identifier: IMPHY011082

Phytochemical name: 9-Tetradecenal

Synonymous chemical names:
9-tetradecenal

External chemical identifiers:
CID:5283368, ZINC:ZINC000001850393, SureChEMBL:SCHEMBL4825159

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Chemical structure information

SMILES:
CCCC/C=C/CCCCCCCC=O

InChI:
InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h5-6,14H,2-4,7-13H2,1H3/b6-5+

InChIKey:
ANJAOCICJSRZSR-AATRIKPKSA-N

DeepSMILES:
CCCC/C=C/CCCCCCCC=O

Functional groups:
C/C=C/C, 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: 1.418

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Chemical structure download