acompound

Showing entry for 7Beta-Hydroxysitosterol

General Compound Information
BXGC Id	BXGC0038610
Compound Name	7Beta-Hydroxysitosterol
Structure
Formula	C29H50O2
InchiKey	SXJVFYZNUGGHRG-PZHNMUJHSA-N
SMILES	CC[C@@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2[C@@H](O)C=C2[C@]1(C)CC[C@@H](C2)O)C
Inchi	InChI=1S/C29H50O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(30)16-21(28)17-26(27)31/h17-20,22-27,30-31H,7-16H2,1-6H3/t19-,20-,22+,23-,24+,25+,26+,27+,28+,29-/m1/s1
IUPAC	(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Molecular Weight	430.38
Pubchem Id	12309569
Chembl Id	CHEMBL455367

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

50242187

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	BXGT009355	Nitric oxide synthase, inducible	reviewed		Nos2	-	>50000	-	-

CHEMBL

CHEMBL455367

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
P29477	BXGT009355	Nitric oxide synthase, inducible	reviewed	-	Nos2	IC50	'>'	50000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01104	Garcinia cambogia	Garcinia cambogia	Medicinal Plant
BXGF01252	Petasites laevigatus	Petasites laevigatus	Medicinal Plant
BXGF01360	Aphelandra chamissoniana	Aphelandra chamissoniana	Others
BXGF01404	Sphaeranthus confertifolius	Sphaeranthus confertifolius	Others
BXGF01556	Ornithoglossum viride	Ornithoglossum viride	Others
BXGF01598	Bryopsis pennata	Bryopsis pennata	Others
BXGF01606	Schizanthus tricolor	Schizanthus tricolor	Others
BXGF01622	Pseudotsuga japonica	Pseudotsuga japonica	Others
BXGF01631	Anodendron affine	Anodendron affine	Medicinal Plant
BXGF01669	Hertia cheirifolia	Hertia cheirifolia	Others
BXGF01720	Cedrela salvadorensis	Cedrela salvadorensis	Others
BXGF02448	Strychnos henningsii	Strychnos henningsii	Medicinal Plant
BXGF02477	Aconitum tanguticum	Aconitum tanguticum	Medicinal Plant
BXGF02641	Acanthophyllum sordidum	Acanthophyllum sordidum	Others
BXGF02697	Vernonia scorpioides	Vernonia scorpioides	Others
BXGF02731	Saussurea involucrata	Saussurea involucrata	Medicinal Plant
BXGF02747	Polyalthia stenopetala	Polyalthia stenopetala	Others
BXGF02879	Roemeria refracta	Roemeria refracta	Others
BXGF02913	Bougainvillea glabra	Bougainvillea glabra	Medicinal Plant
BXGF03015	Gmelina arborea	Gmelina arborea	Medicinal Plant
BXGF04159	Panax spinosus	Panax spinosus	Others
BXGF04376	Aconitum habaense	Aconitum habaense	Others
BXGF04940	Strophanthus hispidus	Strophanthus hispidus	Medicinal Plant
BXGF05436	Rubia tetragona	Rubia tetragona	Others
BXGF05858	Ormosia hosiei	Ormosia hosiei	Medicinal Plant
BXGF06250	Licaria chrysophylla	Licaria chrysophylla	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}