acompound

Showing entry for Cyanin

General Compound Information
BXGC Id	BXGC0037531
Compound Name	Cyanin
Structure
Formula	C27H30O16
InchiKey	RDFLLVCQYHQOBU-ZOTFFYTFSA-O
SMILES	OC[C@H]1O[C@@H](Oc2cc(O)cc3c2cc(O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)c([o+]3)c2ccc(c(c2)O)O)[C@@H]([C@H]([C@@H]1O)O)O
Inchi	InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1
IUPAC	(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Weight	612.17
Pubchem Id	441688
Chembl Id	CHEMBL2425137

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

50005093

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	BXGT005630	Prothrombin	reviewed	Enzyme	F2	-	-	8.6	-
reviewed	BXGT005630	Prothrombin	reviewed	Enzyme	F2	-	75000	-	-

CHEMBL

CHEMBL2425137

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
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	Kd	'='	8630000	nM
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	Inhibition	-	-	-
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	IC50	'='	75000	nM
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	RU	'='	827	-
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	Ka	'='	1	10'2/M

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00151	Pomegranate	Punica granatum	Fruits
BXGF00959	Artemisia hanseniana	Artemisia hanseniana	Others
BXGF01159	Kopsia grandifolia	Kopsia grandifolia	Others
BXGF01281	Ledebouria socialis	Ledebouria socialis	Others
BXGF01361	Lycopus europaeus	Lycopus europaeus	Medicinal Plant
BXGF01400	Dipterocarpus dyeri	Dipterocarpus dyeri	Others
BXGF01518	Ipomoea cairica	Ipomoea cairica	Medicinal Plant
BXGF01699	Ceanothus velutinus	Ceanothus velutinus	Medicinal Plant
BXGF01732	Garcinia scortechinii	Garcinia scortechinii	Others
BXGF01756	Apollonias barbujana	Apollonias barbujana	Others
BXGF01781	Chlorophytum borivilianum	Chlorophytum borivilianum	Medicinal Plant
BXGF02044	Chrysothamnus parryi	Chrysothamnus parryi	Others
BXGF02316	Isodon lophanthoides	Isodon lophanthoides	Medicinal Plant
BXGF02596	Fragaria vesca	Fragaria vesca	Medicinal Plant
BXGF03090	Lasianthus fordii	Lasianthus fordii	Others
BXGF04392	Artemisia carvifolia	Artemisia carvifolia	Others
BXGF04992	Cephalaria uralensis	Cephalaria uralensis	Others
BXGF05096	Aconitum leucostomum	Aconitum leucostomum	Medicinal Plant
BXGF05200	Aquilegia ecalcarata	Aquilegia ecalcarata	Medicinal Plant
BXGF05215	Geranium sylvaticum	Geranium sylvaticum	Others
BXGF05316	Persea mexicana	Persea mexicana	Others
BXGF05441	Haplophyllum ferganicum	Haplophyllum ferganicum	Others
BXGF05478	Callicarpa maingayi	Callicarpa maingayi	Others
BXGF05487	Crotalaria aegyptiaca	Crotalaria aegyptiaca	Others
BXGF05578	Aglaia laxiflora	Aglaia laxiflora	Human Edible Plant
BXGF05766	Dicoma capensis	Dicoma capensis	Medicinal Plant
BXGF05767	Gardenia tubifera	Gardenia tubifera	Medicinal Plant
BXGF05845	Panax innovans	Panax innovans	Others
BXGF05872	Digitalis isabelliana	Digitalis isabelliana	Others
BXGF05873	Scopolia hladnikiana	Scopolia hladnikiana	Others
BXGF05956	Blumea mollis	Blumea mollis	Medicinal Plant
BXGF06070	Perilla frutescens	Perilla frutescens	Medicinal Plant
BXGF06087	Sonchus ortunoi	Sonchus ortunoi	Others
BXGF06111	Pteris radiata	Pteris radiata	Others
BXGF06174	Styrax ferrugineus	Styrax ferrugineus	Medicinal Plant
BXGF06277	Vincetoxicum hirundinaria	Vincetoxicum hirundinaria	Medicinal Plant
BXGF06323	Euphorbia turczaninowii	Euphorbia turczaninowii	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}