acompound

Showing entry for callyspongynic acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0019578
Compound Name	callyspongynic acid
Structure
Formula	C32H38O3
InchiKey	DDVIOADGWIMPIO-ISGQOPDGSA-N
SMILES	C#C[C@H](/C=C/CCCCCC#CC#CCCCC#CCCCC#CCCCCCC#CC(=O)O)O
Inchi	InChI=1S/C32H38O3/c1-2-31(33)29-27-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32(34)35/h1,27,29,31,33H,3,5,7-8,10,12,17-26H2,(H,34,35)/b29-27+/t31-/m1/s1
IUPAC	(E,30S)-30-hydroxydotriacont-28-en-2,9,14,19,21,31-hexaynoic acid
Molecular Weight	470.28
Pubchem Id	636783
Chembl Id	CHEMBL465330

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
P16278	BXGT008213	Beta-galactosidase	reviewed	Enzyme	GLB1	Activity	-	-	-
P10253	BXGT007550	Lysosomal alpha-glucosidase	reviewed	Enzyme	GAA	IC50	'='	0	ug.mL-1
Q9H227	BXGT020447	Cytosolic beta-glucosidase	reviewed	Enzyme	GBA3	Activity	-	-	-
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	Activity	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01731	Corydalis turtschaninovii	Corydalis turtschaninovii	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}