Isocitrate

Isocitric acid

Names
IUPAC name 1-Hydroxypropane-1,2,3-tricarboxylic acid
Identifiers
CAS Number	320-77-4 Y
3D model (Jmol)	Interactive image
ChEBI	CHEBI:30887 Y
ChEMBL	ChEMBL539669 Y
ChemSpider	1161 Y
DrugBank	DB01727 N°
ECHA InfoCard	100.005.713
KEGG	C00311 Y
MeSH	Isocitrate
PubChem	1198
InChI InChI=1S/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13) Y Key: ODBLHEXUDAPZAU-UHFFFAOYSA-N Y InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13) Key: ODBLHEXUDAPZAU-UHFFFAOYAX
SMILES O=C(O)C(CC(=O)O)C(O)C(=O)O
Properties
Chemical formula	C6H8O7
Molar mass	192.124
Melting point	105 °C (221 °F; 378 K)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
N  (what is YN ?)
Infobox references

Isocitric acid is a structural isomer of citric acid. Salts and esters of isocitric acid are known as isocitrates. The isocitrate anion is a substrate of the citric acid cycle. Isocitrate is formed from citrate with the help of the enzyme aconitase, and is acted upon by isocitrate dehydrogenase.

Isocitric acid is commonly used as a marker to detect the authenticity and quality of fruit products, most often citrus juices. In authentic orange juice, for example, the ratio of citric acid to D-isocitric acid is usually less than 130. An isocitric acid value higher than this may be indicative of fruit juice adulteration.

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