IMPPAT Phytochemical information: 
Decanoic acid

Decanoic acid
Summary

IMPPAT Phytochemical identifier: IMPHY003104

Phytochemical name: Decanoic acid

Synonymous chemical names:
capric, capric (decanoic) acid, capric acid, capric acid (c10), capric-acid, decanoic, decanoic acid, decanoic acid (capric acid), decanoic acid*, decanoic acidti, decanoicacid, decylic acid, n-capric acid, n-decanoic acid

External chemical identifiers:
CID:2969, ChEMBL:CHEMBL107498, ChEBI:30813, ZINC:ZINC000001529229, FDASRS:4G9EDB6V73, SureChEMBL:SCHEMBL2682, MolPort-000-881-523
Chemical structure information

SMILES:
CCCCCCCCCC(=O)O

InChI:
InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)

InChIKey:
GHVNFZFCNZKVNT-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC=O)O

Functional groups:
CC(=O)O
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: Branched fatty acids, Unsaturated fatty acids

NP-Likeness score: 0.578


Chemical structure download