Summary

IMPPAT Phytochemical identifier: IMPHY008306

Phytochemical name: Heptadecenoic acid

Synonymous chemical names:
heptadecenoic acid

External chemical identifiers:
CID:5282747, ChEBI:79000, SureChEMBL:SCHEMBL258102

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Chemical structure information

SMILES:
CCCCCCCCCCCCCC/C=C/C(=O)O

InChI:
InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h15-16H,2-14H2,1H3,(H,18,19)/b16-15+

InChIKey:
GEHPRJRWZDWFBJ-FOCLMDBBSA-N

DeepSMILES:
CCCCCCCCCCCCCC/C=C/C=O)O

Functional groups:
C/C=C/C(=O)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 acids and conjugates

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Unsaturated fatty acids

NP-Likeness score: 0.917

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Chemical structure download