acompound

Showing entry for 2-((11bR,12R)-9-Hydroxy-5b,11b-dihydro-6H-3,7,12-trioxa-benzo[a]cyclopenta[i]fluoren-2-yl)-propane-1,2-diol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0046516
Compound Name	2-((11bR,12R)-9-Hydroxy-5b,11b-dihydro-6H-3,7,12-trioxa-benzo[a]cyclopenta[i]fluoren-2-yl)-propane-1,2-diol
Structure
Formula	C20H18O6
InchiKey	JDKOSPKTKADBCU-GKCIPKSASA-N
SMILES	OC[C@@](c1oc2c(c1)c1O[C@@H]3[C@H](c1cc2)COc1c3ccc(c1)O)(O)C
Inchi	InChI=1S/C20H18O6/c1-20(23,9-21)17-7-13-15(25-17)5-4-11-14-8-24-16-6-10(22)2-3-12(16)19(14)26-18(11)13/h2-7,14,19,21-23H,8-9H2,1H3/t14-,19-,20-/m0/s1
IUPAC
Molecular Weight	354.11
Pubchem Id	44264369
Chembl Id	CHEMBL7054

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

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	BXGT006500	Beta-glucuronidase	reviewed		Gusb	-	>30000	-	-
reviewed	BXGT005616	Lysozyme C-1	reviewed		Lyz1	-	>30000	-	-

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
P00697	BXGT005616	Lysozyme C-1	reviewed	-	Lyz1	IC50	'>'	30000	nM
P06760	BXGT006500	Beta-glucuronidase	reviewed	-	Gusb	IC50	'>'	30000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00903	Crotalaria assamica	Crotalaria assamica	Medicinal Plant
BXGF06266	Crotalaria pallida	Crotalaria pallida	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}