acompound

Showing entry for Lycobetaine

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0029547
Compound Name	Lycobetaine
Structure
Formula	C16H11NO3
InchiKey	DFQOXFIPAAMFAU-UHFFFAOYSA-O
SMILES	[O+]=c1cc2CCn3c2c(c1)c1cc2OCOc2cc1c3
Inchi	InChI=1S/C16H11NO3/c18-11-3-9-1-2-17-7-10-4-14-15(20-8-19-14)6-12(10)13(5-11)16(9)17/h3-7H,1-2,8H2/p+1
IUPAC
Molecular Weight	266.08
Pubchem Id	159646
Chembl Id	CHEMBL253553

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
P11387	BXGT007696	DNA topoisomerase 1	reviewed	Enzyme	TOP1	Activity	-	-	-
P11388	BXGT007697	DNA topoisomerase 2-alpha	reviewed	-	TOP2A	Inhibition	-	-	-
Q02880	BXGT012677	DNA topoisomerase 2-beta	reviewed	-	TOP2B	Inhibition	-	-	-
P11387	BXGT007696	DNA topoisomerase 1	reviewed	Enzyme	TOP1	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01038	Eupatorium laevigatum	Eupatorium laevigatum	Medicinal Plant
BXGF01150	Viburnum lantana	Viburnum lantana	Medicinal Plant
BXGF01769	Artemisia juncea	Artemisia juncea	Others
BXGF02952	Hesperocyparis arizonica	Hesperocyparis arizonica	Others
BXGF05126	Crotalaria crispata	Crotalaria crispata	Medicinal Plant
BXGF06163	Atriplex parvifolia	Atriplex parvifolia	Others
BXGF06231	Haplopappus deserticola	Haplopappus deserticola	Medicinal Plant
BXGF06311	Crinum asiaticum	Crinum asiaticum	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}