acompound

Showing entry for Oblongifolin C

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0020201
Compound Name	Oblongifolin C
Structure
Formula	C43H58O6
InchiKey	XIKKSUTXFFVDEF-SSVAQFLFSA-N
SMILES	CC(=CCC[C@@]1(C)[C@H](C/C=C(/CCC=C(C)C)\C)C[C@@]2(C(=O)[C@@]1(CC=C(C)C)C(=O)C(=C2O)C(=O)c1ccc(c(c1)O)O)CC=C(C)C)C
Inchi	InChI=1S/C43H58O6/c1-27(2)13-11-15-31(9)16-18-33-26-42(23-20-29(5)6)38(47)36(37(46)32-17-19-34(44)35(45)25-32)39(48)43(40(42)49,24-21-30(7)8)41(33,10)22-12-14-28(3)4/h13-14,16-17,19-21,25,33,44-45,47H,11-12,15,18,22-24,26H2,1-10H3/b31-16+/t33-,41+,42+,43-
IUPAC
Molecular Weight	670.42
Pubchem Id
Chembl Id	CHEMBL443681

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	BXGT006794	Hepatocyte growth factor receptor	reviewed	Kinase	MET	-	7770	-	-
reviewed	BXGT019646	NAD-dependent protein deacetylase sirtuin-1	reviewed	Epigenetic regulator	SIRT1	-	9000	-	-
reviewed	BXGT018362	NAD-dependent protein deacetylase sirtuin-2	reviewed	Epigenetic regulator	SIRT2	-	22000	-	-
reviewed	BXGT021689	DNA polymerase lambda	reviewed	Enzyme	POLL	-	5200	-	-

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
P08581	BXGT006794	Hepatocyte growth factor receptor	reviewed	Kinase	MET	Inhibition	-	-	-
P08581	BXGT006794	Hepatocyte growth factor receptor	reviewed	Kinase	MET	IC50	'='	7770	nM
P08581	BXGT006794	Hepatocyte growth factor receptor	reviewed	Kinase	MET	Inhibition	'>'	50	%
Q8IXJ6	BXGT018362	NAD-dependent protein deacetylase sirtuin-2	reviewed	Epigenetic regulator	SIRT2	IC50	'='	22000	nM
Q9UGP5	BXGT021689	DNA polymerase lambda	reviewed	Enzyme	POLL	IC50	'='	5200	nM
Q96EB6	BXGT019646	NAD-dependent protein deacetylase sirtuin-1	reviewed	Epigenetic regulator	SIRT1	IC50	'='	9000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01149	Garcinia oblongifolia	Garcinia oblongifolia	Human Edible Plant
BXGF01175	Neomeris annulata	Neomeris annulata	Others
BXGF04031	Garcinia cowa	Garcinia cowa	Medicinal Plant
BXGF04213	Trifolium resupinatum	Trifolium resupinatum	Agricultural Plant
BXGF05434	Zanthoxylum decaryi	Zanthoxylum decaryi	Medicinal Plant
BXGF05715	Cistanche salsa	Cistanche salsa	Medicinal Plant
BXGF06189	Piper wightii	Piper wightii	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}