acompound

Showing entry for Besigomsin

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0026440
Compound Name	Besigomsin
Structure
Formula	C23H28O7
InchiKey	ZWRRJEICIPUPHZ-MYODQAERSA-N
SMILES	COc1cc2C[C@](C)(O)[C@@H](C)Cc3c(c2c(c1OC)OC)c(OC)c1c(c3)OCO1
Inchi	InChI=1S/C23H28O7/c1-12-7-13-8-16-20(30-11-29-16)22(28-6)17(13)18-14(10-23(12,2)24)9-15(25-3)19(26-4)21(18)27-5/h8-9,12,24H,7,10-11H2,1-6H3/t12-,23-/m0/s1
IUPAC
Molecular Weight	416.18
Pubchem Id	3001662
Chembl Id	CHEMBL403578

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
P46063	BXGT010501	ATP-dependent DNA helicase Q1	reviewed	Enzyme	RECQL	Potency	'='	1000	nM
P83916	BXGT012025	Chromobox protein homolog 1	reviewed	Epigenetic regulator	CBX1	Potency	-	89125	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	20596	nM
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	Drug metabolism	'='	10	pmol/min
P20815	BXGT008604	Cytochrome P450 3A5	reviewed	Enzyme	CYP3A5	Drug metabolism	'='	1	pmol/min

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00956	Passiflora incarnata	Passiflora incarnata	Medicinal Plant
BXGF01157	Alstonia muelleriana	Alstonia muelleriana	Others
BXGF01205	Dacrydium cupressinum	Dacrydium cupressinum	Medicinal Plant
BXGF01448	Trigonella grandiflora	Trigonella grandiflora	Others
BXGF01554	Nicotiana undulata	Nicotiana undulata	Others
BXGF01821	Artemisia cina	Artemisia cina	Medicinal Plant
BXGF02757	Tripolium pannonicum	Tripolium pannonicum	Others
BXGF02925	Coreopsis nodosa	Coreopsis nodosa	Others
BXGF03180	Uvaria calamistrata	Uvaria calamistrata	Medicinal Plant
BXGF03508	Haematococcus lacustris	Haematococcus lacustris	Others
BXGF04820	Panax ginseng	Panax ginseng	0
BXGF05413	Glycine tomentella	Glycine tomentella	Human Edible Plant
BXGF05817	Panax schinseng	Panax schinseng	Others
BXGF05834	Schisandra sphenanthera	Schisandra sphenanthera	Medicinal Plant
BXGF05944	Senecio paludaffinis	Senecio paludaffinis	Others
BXGF05977	Schisandra chinensis	Schisandra chinensis	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}