acompound

Showing entry for medicagenic acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0034908
Compound Name	medicagenic acid
Structure
Formula	C30H46O6
InchiKey	IDGXIXSKISLYAC-WNTKNEGGSA-N
SMILES	O[C@H]1C[C@@]2(C)[C@H]([C@]([C@H]1O)(C)C(=O)O)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O)C
Inchi	InChI=1S/C30H46O6/c1-25(2)11-13-30(24(35)36)14-12-27(4)17(18(30)15-25)7-8-20-26(3)16-19(31)22(32)29(6,23(33)34)21(26)9-10-28(20,27)5/h7,18-22,31-32H,8-16H2,1-6H3,(H,33,34)(H,35,36)/t18-,19-,20+,21+,22-,26+,27+,28+,29-,30-/m0/s1
IUPAC	(2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-2,3-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
Molecular Weight	502.33
Pubchem Id	65048
Chembl Id	CHEMBL520726

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
P02699	BXGT005925	Rhodopsin	reviewed	-	RHO	Activity	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00916	Erythrina speciosa	Erythrina speciosa	Others
BXGF00978	Prunus prostrata	Prunus prostrata	Medicinal Plant
BXGF02560	Richteria pyrethroides	Richteria pyrethroides	Others
BXGF04099	Piper divaricatum	Piper divaricatum	Others
BXGF04110	Helichrysum drakensbergense	Helichrysum drakensbergense	Others
BXGF04167	Santolina pectinata	Santolina pectinata	Others
BXGF04185	Prosopis africana	Prosopis africana	Medicinal Plant
BXGF04364	Commiphora sphaerocarpa	Commiphora sphaerocarpa	Others
BXGF04374	Satureja vulgaris	Satureja vulgaris	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}