acompound

Showing entry for COCHINCHINENIN C

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0045239
Compound Name	COCHINCHINENIN C
Structure
Formula	C33H34O7
InchiKey	SLJWKFROLINAGW-UHFFFAOYSA-N
SMILES	COc1ccc(cc1)C(c1cc(CCC(=O)c2ccc(cc2)O)c(cc1O)OC)CCc1ccc(cc1OC)O
Inchi	InChI=1S/C33H34O7/c1-38-27-14-7-21(8-15-27)28(16-9-23-6-13-26(35)19-32(23)39-2)29-18-24(33(40-3)20-31(29)37)10-17-30(36)22-4-11-25(34)12-5-22/h4-8,11-15,18-20,28,34-35,37H,9-10,16-17H2,1-3H3
IUPAC
Molecular Weight	542.23
Pubchem Id	23634528
Chembl Id	CHEMBL254649

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

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	BXGT005630	Prothrombin	reviewed	Enzyme	F2	-	>9200	-	-
reviewed	BXGT009187	Dipeptidyl peptidase 4	reviewed	Enzyme	DPP4	-	>36900	-	-

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
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	K	'='	12	10'4/M
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	K	'='	18	10'4/M
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	Activity	'='	14	%
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	KSV	'='	17	10'4/M
P27487	BXGT009187	Dipeptidyl peptidase 4	reviewed	Enzyme	DPP4	IC50	'>'	36900	nM
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	Kq	'='	17	10'12/M/s
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	KSV	'='	14	10'4/M
P00734	BXGT005630	Prothrombin	reviewed	Enzyme	F2	IC50	'>'	9200	nM
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	K	'='	25	10'4/M
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	Activity	-	-	-
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	deltaG	'='	-30	kJ/mol
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	Kq	'='	12	10'12/M/s
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	KSV	'='	12	10'4/M
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	deltaG	'='	-31	kJ/mol
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	deltaG	'='	-30	kJ/mol
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	Kq	'='	14	10'12/M/s
P02768	BXGT005955	Serum albumin	reviewed	Transporter	ALB	deltaH	'='	-55	kJ/mol

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01460	Dracaena cochinchinensis	Dracaena cochinchinensis	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}