acompound

Showing entry for Adenosine-3'-Monophosphate

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0051869
Compound Name	Adenosine-3'-Monophosphate
Structure
Formula	C10H14N5O7P
InchiKey	LNQVTSROQXJCDD-KQYNXXCUSA-N
SMILES	OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(O)O)O)n1cnc2c1ncnc2N
Inchi	InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1
IUPAC	[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
Molecular Weight	347.06
Pubchem Id	41211
Chembl Id	CHEMBL576739

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
P00654	BXGT005609	Ribonuclease U2	reviewed	RNU2	-	-	-	-	-
O14936	BXGT004114	Peripheral plasma membrane protein CASK	reviewed	CASK	Kinase	-	-	-	-
P26093	BXGT009087	Lipoprotein E	reviewed	hel	-	-	-	-	-
Q8U1S6	BXGT018874	CRISPR system Cmr subunit Cmr2	reviewed	cmr2	-	-	-	-	-
A0A140NFI1	BXGT000664	RNA 2',3'-cyclic phosphodiesterase	unreviewed	thpR	-	-	-	-	-

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	BXGT009436	Adenosine receptor A1	reviewed	G-protein coupled receptor	ADORA1	-	-	-	440

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
P30542	BXGT009436	Adenosine receptor A1	reviewed	G-protein coupled receptor	ADORA1	EC50	'='	440	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01866	Heliotropium indicum	Heliotropium indicum	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}