acompound

Showing entry for Garcinone D

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0005338
Compound Name	Garcinone D
Structure
Formula	C24H28O7
InchiKey	TYALNCRUIKOKGP-UHFFFAOYSA-N
SMILES	COC1=C(O)C=C2OC3=C(C(O)=C(CC=C(C)C)C(O)=C3)C(=O)C2=C1CCC(C)(C)O
Inchi	InChI=1S/C24H28O7/c1-12(2)6-7-13-15(25)10-18-20(21(13)27)22(28)19-14(8-9-24(3,4)29)23(30-5)16(26)11-17(19)31-18/h6,10-11,25-27,29H,7-9H2,1-5H3
IUPAC	1,3,6-trihydroxy-8-(3-hydroxy-3-methylbutyl)-7-methoxy-2-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
Molecular Weight	428.47
Pubchem Id	5495926
Chembl Id	CHEMBL462879

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	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	-	5200	-	-
reviewed	BXGT008526	Nuclear factor NF-kappa-B p105 subunit	reviewed	Transcription factor	NFKB1	-	>20000	-	-
reviewed	BXGT012754	Transcription factor p65	reviewed	Transcription factor	RELA	-	3200	-	-
reviewed	BXGT007573	Sialidase	reviewed		nanH	-	5700	-	-
reviewed	BXGT007573	Sialidase	reviewed		nanH	3300	-	-	-

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
P10481	BXGT007573	Sialidase	reviewed	-	nanH	IC50	'='	5700	nM
P19838	BXGT008526	Nuclear factor NF-kappa-B p105 subunit	reviewed	Transcription factor	NFKB1	IC50	'>'	20000	nM
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	IC50	'='	5200	nM
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	Activity	'='	50	%
P10481	BXGT007573	Sialidase	reviewed	-	nanH	Ki	'='	3300	nM
Q04206	BXGT012754	Transcription factor p65	reviewed	Transcription factor	RELA	IC50	'='	3200	nM
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	Activity	'='	10	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00373	Purple mangosteen	Garcinia mangostana	Fruits
BXGF00823	Fruits		Fruits
BXGF00848	Mundu	Garcinia dulcis	Fruits
BXGF00864	Nicotiana sylvestris	Nicotiana sylvestris	Others
BXGF00927	Dolomiaea souliei	Dolomiaea souliei	Others
BXGF01007	Eucalyptus camaldulensis	Eucalyptus camaldulensis	Medicinal Plant
BXGF03915	Cratoxylum cochinchinense	Cratoxylum cochinchinense	Medicinal Plant
BXGF03981	Senecio vellereus	Senecio vellereus	Others
BXGF04519	Serpocaulon triseriale	Serpocaulon triseriale	Others
BXGF05090	Lonicera hypoleuca	Lonicera hypoleuca	Human Edible Plant
BXGF05157	Garcinia morella	Garcinia morella	Medicinal Plant
BXGF05213	Halimodendron halodendron	Halimodendron halodendron	Others
BXGF06008	Aster bellidiastrum	Aster bellidiastrum	Others
BXGF06276	Wibelia divaricata	Wibelia divaricata	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}