Summary
IMPPAT Phytochemical identifier: IMPHY006025
Phytochemical name: 11-Hydroxyundecanoic acid
Synonymous chemical names:11-hydroxyundecanoic acid, undecanoic acid, 11-hydroxy
External chemical identifiers:CID:77237, ChEBI:79126, ZINC:ZINC000002168567, SureChEMBL:SCHEMBL275368, MolPort-000-156-417
Chemical structure information
SMILES:
OCCCCCCCCCCC(=O)OInChI:
InChI=1S/C11H22O3/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h12H,1-10H2,(H,13,14)InChIKey:
KNRCBASNXNXUQQ-UHFFFAOYSA-NDeepSMILES:
OCCCCCCCCCCC=O)OFunctional groups:
CC(=O)O, CO
Chemical classification
ClassyFire Kingdom: Organic compoundsClassyFire Superclass: Organic acids and derivativesClassyFire Class: Hydroxy acids and derivatives
ClassyFire Subclass: Medium-chain hydroxy acids and derivatives
NP Classifier Biosynthetic pathway: Fatty acids
NP Classifier Superclass: Fatty Acids and Conjugates
NP Classifier Class: Hydroxy fatty acids
NP-Likeness score: 0.699
Chemical structure download