Showing entry for gamma-Mangostin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0007559
Compound Namegamma-Mangostin
Structure
FormulaC23H24O6
InchiKeyVEZXFTKZUMARDU-UHFFFAOYSA-N
SMILESCC(C)=CCC1=C(O)C2=C(OC3=CC(O)=C(O)C(CC=C(C)C)=C3C2=O)C=C1O
InchiInChI=1S/C23H24O6/c1-11(2)5-7-13-15(24)9-18-20(22(13)27)23(28)19-14(8-6-12(3)4)21(26)16(25)10-17(19)29-18/h5-6,9-10,24-27H,7-8H2,1-4H3
IUPAC1,3,6,7-tetrahydroxy-2,8-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
Molecular Weight396.43
Pubchem Id5464078
Chembl IdCHEMBL260553
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 MKT
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
P02766 BXGT005953 Transthyretin reviewed TTR Transporter - - - -
Binding DB 50241453
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 BXGT010694 Fatty acid synthase reviewed Enzyme FASN - 1240 - -
reviewed BXGT007717 Aromatase reviewed Enzyme CYP19A1 - 4970 - -
reviewed BXGT007717 Aromatase reviewed Enzyme CYP19A1 - 6900 - -
reviewed BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed IDH1 3170 - - -
reviewed BXGT007573 Sialidase reviewed nanH - 2200 - -
reviewed BXGT007573 Sialidase reviewed nanH 800 - - -
reviewed BXGT008837 Prostaglandin G/H synthase 1 reviewed Enzyme PTGS1 - 800 - -
reviewed BXGT009816 Prostaglandin G/H synthase 2 reviewed Enzyme PTGS2 - 2000 - -
CHEMBL CHEMBL260553
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
P11511 BXGT007717 Aromatase reviewed Enzyme CYP19A1 IC50 '=' 4970 nM
P49327 BXGT010694 Fatty acid synthase reviewed Enzyme FASN IC50 '=' 1240 nM
Q64725 BXGT016130 Tyrosine-protein kinase SYK reviewed - Syk Activity - - -
P10481 BXGT007573 Sialidase reviewed - nanH Ki '=' 7410 nM
P11511 BXGT007717 Aromatase reviewed Enzyme CYP19A1 IC50 '=' 6900 nM
P11511 BXGT007717 Aromatase reviewed Enzyme CYP19A1 Activity '=' 0 %
P10481 BXGT007573 Sialidase reviewed - nanH IC50 '=' 2200 nM
P23219 BXGT008837 Prostaglandin G/H synthase 1 reviewed Enzyme PTGS1 IC50 '=' 800 nM
Q2M2H8 BXGT026100 Probable maltase-glucoamylase 2 reviewed Enzyme MGAM2 IC50 '=' 1700 nM
P14410 BXGT008009 Sucrase-isomaltase, intestinal reviewed Enzyme SI IC50 '=' 1700 nM
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA IC50 '=' 1700 nM
O43451 BXGT004594 Maltase-glucoamylase, intestinal reviewed Enzyme MGAM IC50 '=' 1700 nM
P35354 BXGT009816 Prostaglandin G/H synthase 2 reviewed Enzyme PTGS2 IC50 '=' 2000 nM
Q07014 BXGT012913 Tyrosine-protein kinase Lyn reviewed - Lyn Activity - - -
P11511 BXGT007717 Aromatase reviewed Enzyme CYP19A1 Activity '=' 4 %
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Ki '=' 3170 nM
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 Ki '=' 2700 nM
P10481 BXGT007573 Sialidase reviewed - nanH Inhibition - - -
P10481 BXGT007573 Sialidase reviewed - nanH Ki '=' 800 nM
Q04206 BXGT012754 Transcription factor p65 reviewed Transcription factor RELA IC50 - - -
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 IC50 '=' 2800 nM
Q2M2H8 BXGT026100 Probable maltase-glucoamylase 2 reviewed Enzyme MGAM2 Inhibition - - -
P14410 BXGT008009 Sucrase-isomaltase, intestinal reviewed Enzyme SI Inhibition - - -
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA Inhibition - - -
O43451 BXGT004594 Maltase-glucoamylase, intestinal reviewed Enzyme MGAM Inhibition - - -
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 Inhibition - - -
Q2M2H8 BXGT026100 Probable maltase-glucoamylase 2 reviewed Enzyme MGAM2 Ki '=' 1400 nM
P14410 BXGT008009 Sucrase-isomaltase, intestinal reviewed Enzyme SI Ki '=' 1400 nM
P10253 BXGT007550 Lysosomal alpha-glucosidase reviewed Enzyme GAA Ki '=' 1400 nM
O43451 BXGT004594 Maltase-glucoamylase, intestinal reviewed Enzyme MGAM Ki '=' 1400 nM
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
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
BXGF05033 garcinia esculenta garcinia esculenta Human Edible Plant
BXGF05090 Lonicera hypoleuca Lonicera hypoleuca Human Edible 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