acompound

Showing entry for Proanthocyanidin A2

General Compound Information
BXGC Id	BXGC0036379
Compound Name	Proanthocyanidin A2
Structure
Formula	C30H24O12
InchiKey	NSEWTSAADLNHNH-LSBOWGMISA-N
SMILES	Oc1cc(O)c2c(c1)O[C@@]1([C@@H]([C@H]2c2c(O1)cc(c1c2O[C@@H]([C@@H](C1)O)c1ccc(c(c1)O)O)O)O)c1ccc(c(c1)O)O
Inchi	InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26-,27-,29-,30+/m1/s1
IUPAC
Molecular Weight	576.13
Pubchem Id	124025
Chembl Id	CHEMBL286933

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

CHEMBL286933

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
Q9YQ12	BXGT022394	Protease	unreviewed	-	protease	Inhibition	'='	-2	%
P15692	BXGT008147	Vascular endothelial growth factor A	reviewed	Signaling	VEGFA	Kd	-	-	-
P80025	BXGT011867	Lactoperoxidase	reviewed	-	LPO	Kcat	'='	60	/s
Q72547	BXGT016709	Reverse transcriptase/RNaseH	unreviewed	-	pol	Inhibition	'='	18	%
Q9YQ12	BXGT022394	Protease	unreviewed	-	protease	IC50	'>'	100	ug.mL-1
P80025	BXGT011867	Lactoperoxidase	reviewed	-	LPO	Kcat/Km	'='	4	/uM/s
P80025	BXGT011867	Lactoperoxidase	reviewed	-	LPO	Km	'='	12660	nM
P49763	BXGT010737	Placenta growth factor	reviewed	Signaling	PGF	Kd	-	-	-
P00690	BXGT005612	Pancreatic alpha-amylase	reviewed	-	AMY2	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00182	Cocoa bean	Theobroma cacao	Cocoa and cocoa products
BXGF00194	Lingonberry	Vaccinium vitis-idaea	Fruits
BXGF00373	Purple mangosteen	Garcinia mangostana	Fruits
BXGF00864	Nicotiana sylvestris	Nicotiana sylvestris	Others
BXGF00899	Orthosphenia mexicana	Orthosphenia mexicana	Others
BXGF00927	Dolomiaea souliei	Dolomiaea souliei	Others
BXGF00933	Eupatorium gracile	Eupatorium gracile	Medicinal Plant
BXGF01007	Eucalyptus camaldulensis	Eucalyptus camaldulensis	Medicinal Plant
BXGF01452	Baccharis megapotamica	Baccharis megapotamica	Others
BXGF01646	Alstonia deplanchei	Alstonia deplanchei	Others
BXGF01753	Stevia mercedensis	Stevia mercedensis	Others
BXGF01861	Senecio latifolius	Senecio latifolius	Others
BXGF01926	Flemingia congesta	Flemingia congesta	Medicinal Plant
BXGF01950	Senecio rivularis	Senecio rivularis	Medicinal Plant
BXGF01972	Ficus simplicissima	Ficus simplicissima	Medicinal Plant
BXGF02063	Quercus dentata	Quercus dentata	Medicinal Plant
BXGF02114	Aconitum pseudohuiliense	Aconitum pseudohuiliense	Medicinal Plant
BXGF02178	Erigeron crispus	Erigeron crispus	Others
BXGF02229	Marrubium supinum	Marrubium supinum	Medicinal Plant
BXGF02260	Cacalia bicolor	Cacalia bicolor	Others
BXGF02279	Ceratozamia fuscoviridis	Ceratozamia fuscoviridis	Others
BXGF02292	Styrax perkinsiae	Styrax perkinsiae	Others
BXGF02339	Haplophyllum dauricum	Haplophyllum dauricum	Others
BXGF02360	Solanum elaeagnifolium	Solanum elaeagnifolium	Medicinal Plant
BXGF02430	Thuja standishii	Thuja standishii	Medicinal Plant
BXGF03352	Verbesina rupestris	Verbesina rupestris	Others
BXGF03479	Bombax ceiba	Bombax ceiba	Medicinal Plant
BXGF03839	Asteriscus graveolens	Asteriscus graveolens	Others
BXGF03981	Senecio vellereus	Senecio vellereus	Others
BXGF04087	Erysimum odoratum	Erysimum odoratum	Others
BXGF04092	Heterotheca inuloides	Heterotheca inuloides	Medicinal Plant
BXGF04098	Delphinium andersoni	Delphinium andersoni	Others
BXGF04123	Swinglea glutinosa	Swinglea glutinosa	Human Edible Plant
BXGF04126	Vismia jefensis	Vismia jefensis	Others
BXGF04142	Angelica tarokoensis	Angelica tarokoensis	Others
BXGF04147	Swertia delavayi	Swertia delavayi	Others
BXGF04165	Epimedium davidii	Epimedium davidii	Medicinal Plant
BXGF04168	Globba malaccensis	Globba malaccensis	Medicinal Plant
BXGF04175	Diphasia angolensis	Diphasia angolensis	Others
BXGF04182	Knightia excelsa	Knightia excelsa	Medicinal Plant
BXGF04199	Isodon japonicus	Isodon japonicus	Medicinal Plant
BXGF04207	Solanum acaule	Solanum acaule	Others
BXGF04216	Frullania tamarisci	Frullania tamarisci	Others
BXGF04221	Alangium premnifolium	Alangium premnifolium	Others
BXGF04233	Saussurea carthamoides	Saussurea carthamoides	Others
BXGF04239	Citrus glauca	Citrus glauca	Human Edible Plant
BXGF04250	Galenia africana	Galenia africana	Medicinal Plant
BXGF04264	Micromeria pineolens	Micromeria pineolens	Others
BXGF04269	Gnidia lamprantha	Gnidia lamprantha	Medicinal Plant
BXGF04276	Ilex amara	Ilex amara	Others
BXGF04295	Leonurus glaucescens	Leonurus glaucescens	Medicinal Plant
BXGF04342	Salacia madagascariensis	Salacia madagascariensis	Human Edible Plant
BXGF04343	Maba buxifolia	Maba buxifolia	Medicinal Plant
BXGF04519	Serpocaulon triseriale	Serpocaulon triseriale	Others
BXGF04777	Quercus sessiliflora	Quercus sessiliflora	Others
BXGF04831	Strychnos tabascana	Strychnos tabascana	Others
BXGF04975	Xanthoceras sorbifolia	Xanthoceras sorbifolia	Medicinal Plant
BXGF05090	Lonicera hypoleuca	Lonicera hypoleuca	Human Edible Plant
BXGF05213	Halimodendron halodendron	Halimodendron halodendron	Others
BXGF05269	Hypericum perforatum	Hypericum perforatum	Medicinal Plant
BXGF05278	Relhania pumila	Relhania pumila	Others
BXGF05312	Critonia quadrangularis	Critonia quadrangularis	Others
BXGF05480	Lepidium draba	Lepidium draba	Medicinal Plant
BXGF05529	Oxyanthus speciosus	Oxyanthus speciosus	Medicinal Plant
BXGF05854	Codium decorticatum	Codium decorticatum	Others
BXGF05877	Rheum tanguticum	Rheum tanguticum	Medicinal Plant
BXGF06008	Aster bellidiastrum	Aster bellidiastrum	Others
BXGF06154	Metalasia bolusii	Metalasia bolusii	Others
BXGF06173	Aconitum sachalinense	Aconitum sachalinense	Medicinal Plant
BXGF06276	Wibelia divaricata	Wibelia divaricata	Others
BXGF06292	Centrosema pascuorum	Centrosema pascuorum	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}