acompound

Showing entry for Eridictiol

General Compound Information
BXGC Id	BXGC0030299
Compound Name	Eridictiol
Structure
Formula	C22H22O11
InchiKey	WKUHPOMCLBLCOV-MIUGBVLSSA-N
SMILES	OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)c2ccc(c(c2)O)OC)[C@@H]([C@H]([C@@H]1O)O)O
Inchi	InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1
IUPAC	5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular Weight	462.12
Pubchem Id	11016019
Chembl Id	CHEMBL488001

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

CHEMBL488001

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
O75874	BXGT005157	Isocitrate dehydrogenase [NADP] cytoplasmic	reviewed	-	IDH1	Activity	'='	111	%
P80457	BXGT011911	Xanthine dehydrogenase/oxidase	reviewed	-	XDH	Inhibition	'='	28	%
O75874	BXGT005157	Isocitrate dehydrogenase [NADP] cytoplasmic	reviewed	-	IDH1	Activity	'='	107	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00131	Parsley	Petroselinum crispum	Herbs and Spices
BXGF01301	Vepris nobilis	Vepris nobilis	Medicinal Plant
BXGF02100	Convallaria majalis	Convallaria majalis	Medicinal Plant
BXGF02275	Trichosanthes kirilowii maxim	Trichosanthes kirilowii maxim	Others
BXGF02357	Euodia bodinieri	Euodia bodinieri	Others
BXGF02513	Rabdosia angustifolia	Rabdosia angustifolia	Others
BXGF02978	Tetradium ruticarpum	Tetradium ruticarpum	Medicinal Plant
BXGF03078	Chrysanthemum x morifolium	Chrysanthemum x morifolium	Medicinal Plant
BXGF03288	Smilax bracteata	Smilax bracteata	Medicinal Plant
BXGF03319	Trichosanthes kirilowii	Trichosanthes kirilowii	Medicinal Plant
BXGF03432	Chrysanthemum indicum	Chrysanthemum indicum	Medicinal Plant
BXGF03664	Tynanthus panurensis	Tynanthus panurensis	Others
BXGF03961	Scutellaria sieberi	Scutellaria sieberi	Others
BXGF04026	Christisonia bicolor	Christisonia bicolor	Others
BXGF04149	Atroxima liberica	Atroxima liberica	Others
BXGF04227	Linum crispum	Linum crispum	Others
BXGF04249	Palafoxia texana	Palafoxia texana	Others
BXGF04341	Sanguisorba officinalis	Sanguisorba officinalis	Medicinal Plant
BXGF04889	Pogostemon cablin	Pogostemon cablin	Medicinal Plant
BXGF05322	Trichosanthes rosthornii	Trichosanthes rosthornii	Medicinal Plant
BXGF05356	Euodia officinalis	Euodia officinalis	Others
BXGF05420	Lawsonia inermis	Lawsonia inermis	Medicinal Plant
BXGF05711	Bergenia crassifolia	Bergenia crassifolia	Medicinal Plant
BXGF06002	Euodia ruticarpa	Euodia ruticarpa	Others
BXGF06003	Pseudocinchona pachyceras	Pseudocinchona pachyceras	Others
BXGF06080	Licaria brasiliensis	Licaria brasiliensis	Others
BXGF06102	Crotalaria orixensis	Crotalaria orixensis	Human Edible 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}