Summary

IMPPAT Phytochemical identifier: IMPHY004296

Phytochemical name: 11-Hydroxyoctadecanoic acid

Synonymous chemical names:
11-hydroxyoctadecanoic acid

External chemical identifiers:
CID:5282910, ChEBI:165793, SureChEMBL:SCHEMBL634073

---

Chemical structure information

SMILES:
CCCCCCCC(CCCCCCCCCC(=O)O)O

InChI:
InChI=1S/C18H36O3/c1-2-3-4-8-11-14-17(19)15-12-9-6-5-7-10-13-16-18(20)21/h17,19H,2-16H2,1H3,(H,20,21)

InChIKey:
CJUFNCPPYUSJPR-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCC=O)O)))))))))))O

Functional groups:
CC(=O)O, CO

---

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: Octadecanoids

NP Classifier Class: Other Octadecanoids

NP-Likeness score: 0.776

---

Chemical structure download