acompound

Showing entry for (-)-Maackiain

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0008179
Compound Name	(-)-Maackiain
Structure
Formula	C16H12O5
InchiKey	HUKSJTUUSUGIDC-UHFFFAOYSA-N
SMILES	OC1=CC2=C(C=C1)C1OC3=CC4=C(OCO4)C=C3C1CO2
Inchi	InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2
IUPAC	5,7,11,19-tetraoxapentacyclo[10.8.0.02,1?.0?,?.013,1?]icosa-2,4(8),9,13(18),14,16-hexaen-16-ol
Molecular Weight	284.26
Pubchem Id	363863
Chembl Id	CHEMBL239047

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
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Potency	'='	39810	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00047	Chickpea	Cicer arietinum	Pulses
BXGF00819	Pulses		Pulses
BXGF02213	Glycyrrhiza sp.	Glycyrrhiza sp.	Others
BXGF02523	Andira inermis	Andira inermis	Medicinal Plant
BXGF02852	Sophora flavescens	Sophora flavescens	Medicinal Plant
BXGF03106	Lythrum salicaria	Lythrum salicaria	Medicinal Plant
BXGF03152	Sophora japonica	Sophora japonica	Medicinal Plant
BXGF03521	Sophora tomentosa	Sophora tomentosa	Medicinal Plant
BXGF04150	Erycibe expansa	Erycibe expansa	Medicinal Plant
BXGF04435	Derris scandens	Derris scandens	Medicinal Plant
BXGF05890	Sophora tonkinensis	Sophora tonkinensis	Others
BXGF06009	Picrasma quassioides	Picrasma quassioides	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}