acompound

Showing entry for (-)-Pseudoephedrine

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0040899
Compound Name	(-)-Pseudoephedrine
Structure
Formula	C10H15NO
InchiKey	KWGRBVOPPLSCSI-SCZZXKLOSA-N
SMILES	CN[C@@H]([C@@H](c1ccccc1)O)C
Inchi	InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10+/m1/s1
IUPAC	(1R,2R)-2-(methylamino)-1-phenylpropan-1-ol
Molecular Weight	165.12
Pubchem Id	62946
Chembl Id	CHEMBL2110905

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

n.a

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

Binding DB

n.a

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

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
P17988	BXGT008363	Sulfotransferase 1A1	reviewed	-	Sult1a1	Ratio	'='	0	-
P17988	BXGT008363	Sulfotransferase 1A1	reviewed	-	Sult1a1	Km	'='	11000000	nM
P17988	BXGT008363	Sulfotransferase 1A1	reviewed	-	Sult1a1	Vmax	'='	40	nM min-1

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF02153	Sida cordifolia	Sida cordifolia	Medicinal Plant
BXGF02635	Ephedra sinica	Ephedra sinica	Medicinal Plant
BXGF03282	Ephedra intermedia	Ephedra intermedia	Medicinal Plant
BXGF03667	Ephedra distachya	Ephedra distachya	Medicinal Plant
BXGF03960	Conium maculatum	Conium maculatum	Medicinal Plant
BXGF04564	Ephedra equisetina	Ephedra equisetina	Medicinal Plant
BXGF05330	Arum ternatum thunb	Arum ternatum thunb	Others

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}