Hydroxycitric Acid Tripotassium Salt Monohydrate

Catalog:	BB064050
Product Name:	Hydroxycitric Acid Tripotassium Salt Monohydrate
Synonyms:	Potassium Hydroxycitrate Tribasic Monohydrate; 3-C-Carboxy-2-deoxypentaric Acid Tripotassium Salt Monohydrate

Technical Data

IUPAC Name:	dipotassium2-(2-hydroperoxy-2-oxoethyl)-2-hydroxybutanedioate
Description:	Hydroxycitric Acid is the hydroxyl derivative of citric acid with potential for modulation of lipid metabolism.
Molecular Weight:	340.41
Molecular Formula:	C6H5O8K3·H2O
Canonical SMILES:	C(C(=O)[O-])C(CC(=O)OO)(C(=O)[O-])O.[K+].[K+]
InChI:	InChI=1S/C6H8O8.2K/c7-3(8)1-6(12,5(10)11)2-4(9)14-13/h12-13H,1-2H2,(H,7,8)(H,10,11)/q2*+1/p-2
InChI Key:	DBODYJNKCUPHHN-UHFFFAOYSA-L
Melting Point:	>188°C (dec.)
Solubility:	Methanol (Slightly), Water (Slightly)
Appearance:	White to Light Beige Solid
Storage:	4°C, Hygroscopic
References:	Shara, M. et al. Mol. Chem. Biochem., 254, 339 (2003).

Complexity:	248
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	3
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	283.9336801
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	8
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	283.9336801
Rotatable Bond Count:	4
Topological Polar Surface Area:	147Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0