ISOCITRIC-ACID

Structure

2D structure of ISOCITRIC-ACID
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 1198

Names and identifiers

Name

ISOCITRIC-ACID

IUPAC name

1-hydroxypropane-1,2,3-tricarboxylic acid

SMILES

C(C(C(C(=O)O)O)C(=O)O)C(=O)O

General information

Molecular formula

C6H8O7

Molecular weight

192.12 g/mol

Monoisotopic mass

192.0270 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Daucus carota L. root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Urtica dioica L. - -
Blaschek, W., Hansel, R., Keller, K., Reichling, J., Rimpler, H., and Schneider, G. eds. 1998. Hager's Handbuch der Pharmazeutischen Praxis, Auflage Band 2 (A-K), 909 pp., (L-Z), 858 pp. Springer-Verlag, Berlin.