Summary

IMPPAT Phytochemical identifier: IMPHY009390

Phytochemical name: Hydroxycitric acid

Synonymous chemical names:
(-) hydroxycitric acid, (-)-hydroxycitric acid, (-)hydroxycitric acid, hydroxycitric acid

External chemical identifiers:
CID:123908, ChEMBL:CHEMBL2007728, ChEBI:176344, SureChEMBL:SCHEMBL108615, MolPort-022-383-270

---

Chemical structure information

SMILES:
OC(=O)CC(C(C(=O)O)O)(C(=O)O)O

InChI:
InChI=1S/C6H8O8/c7-2(8)1-6(14,5(12)13)3(9)4(10)11/h3,9,14H,1H2,(H,7,8)(H,10,11)(H,12,13)

InChIKey:
ZMJBYMUCKBYSCP-UHFFFAOYSA-N

DeepSMILES:
OC=O)CCCC=O)O))O))C=O)O))O

Functional groups:
CC(=O)O, CO

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Tricarboxylic 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: 1.295

---

Chemical structure download