acompound

Showing entry for (-)-Hydroxycitrate

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0049442
Compound Name	(-)-Hydroxycitrate
Structure
Formula	C6H8O8
InchiKey	ZMJBYMUCKBYSCP-CVYQJGLWSA-N
SMILES	OC(=O)C[C@]([C@@H](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)/t3-,6+/m1/s1
IUPAC	(1S,2S)-1,2-dihydroxypropane-1,2,3-tricarboxylic acid
Molecular Weight	208.02
Pubchem Id	185620
Chembl Id	CHEMBL118715

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
P53396	BXGT010988	ATP-citrate synthase	reviewed	ACLY	Enzyme	-	-	-	-

Binding DB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
reviewed	BXGT008250	ATP-citrate synthase	reviewed		Acly	150	-	-	-
reviewed	BXGT008250	ATP-citrate synthase	reviewed		Acly	8000	-	-	-
reviewed	BXGT010988	ATP-citrate synthase	reviewed	Enzyme	ACLY	-	150	-	-

CHEMBL

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
P16638	BXGT008250	ATP-citrate synthase	reviewed	-	Acly	Ki	-	-	-
P16638	BXGT008250	ATP-citrate synthase	reviewed	-	Acly	Ki	'='	150	nM
P53396	BXGT010988	ATP-citrate synthase	reviewed	Enzyme	ACLY	IC50	'='	150	nM
P16638	BXGT008250	ATP-citrate synthase	reviewed	-	Acly	Ki	'='	8000	nM
P53396	BXGT010988	ATP-citrate synthase	reviewed	Enzyme	ACLY	Inhibition	-	-	-
P53396	BXGT010988	ATP-citrate synthase	reviewed	Enzyme	ACLY	Ki	'='	300000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF05669	Marrubium velutinum	Marrubium velutinum	Medicinal Plant

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}