acompound

Showing entry for sphaeropsidin C

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0016725
Compound Name	sphaeropsidin C
Structure
Formula	C20H28O4
InchiKey	VIDNIVWPSMVGJV-MVJPYGJCSA-N
SMILES	C=C[C@@]1(C)CC[C@]2(C(=C1)C(=O)C[C@@H]1[C@@]2(CCCC1(C)C)C(=O)O)O
Inchi	InChI=1S/C20H28O4/c1-5-18(4)9-10-20(24)13(12-18)14(21)11-15-17(2,3)7-6-8-19(15,20)16(22)23/h5,12,15,24H,1,6-11H2,2-4H3,(H,22,23)/t15-,18-,19-,20+/m0/s1
IUPAC	(4aR,4bR,7R,10aS)-7-ethenyl-4b-hydroxy-1,1,7-trimethyl-9-oxo-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylic acid
Molecular Weight	332.2
Pubchem Id	10544575
Chembl Id	CHEMBL1934132

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
Q13148	BXGT013318	TAR DNA-binding protein 43	reviewed	-	TARDBP	Potency	-	794	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01013	Trichilia hirta	Trichilia hirta	Human Edible Plant
BXGF02692	Plectocephalus chilensis	Plectocephalus chilensis	Others
BXGF02794	Ephedra aphylla	Ephedra aphylla	Others
BXGF05086	Quercus suber	Quercus suber	Medicinal Plant
BXGF05148	Munronia delavayi	Munronia delavayi	Others
BXGF05251	Allium neapolitanum	Allium neapolitanum	Medicinal Plant
BXGF05342	Cycas armstrongii	Cycas armstrongii	Human Edible Plant
BXGF05395	Cycas revoluta	Cycas revoluta	Medicinal Plant
BXGF05591	Mammillaria magnimamma	Mammillaria magnimamma	Others
BXGF05618	Licaria armeniaca	Licaria armeniaca	Human Edible Plant
BXGF05733	Typha domingensis	Typha domingensis	Medicinal 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}