acompound

Showing entry for Guttiferone I

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0031435
Compound Name	Guttiferone I
Structure
Formula	C43H58O6
InchiKey	XIKKSUTXFFVDEF-VOWDTJCUSA-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	CHEMBL445689

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
P55055	BXGT011101	Oxysterols receptor LXR-beta	reviewed	Nuclear receptor	NR1H2	Ratio IC50	'='	5	-
Q13133	BXGT013315	Oxysterols receptor LXR-alpha	reviewed	Nuclear receptor	NR1H3	Ratio IC50	'='	5	-
P55055	BXGT011101	Oxysterols receptor LXR-beta	reviewed	Nuclear receptor	NR1H2	IC50	'>'	15000	nM
Q13133	BXGT013315	Oxysterols receptor LXR-alpha	reviewed	Nuclear receptor	NR1H3	IC50	'='	3400	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01997	Garcinia paucinervis	Garcinia paucinervis	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}