input word = C00031902

Metabolite InformationStructural formula
Name Isogarcinol
Cambogin
Formula C38H50O6
Mw 602.36073933
CAS RN 71117-97-0
C_ID C00031902 ,
InChIKey KXTNVBQRLRYVCO-IDPISXRDNA-N
InChICode InChI=1S/C38H50O6/c1-22(2)11-14-26-20-37-21-27(15-12-23(3)4)36(9,10)44-33(37)30(31(41)25-13-16-28(39)29(40)19-25)32(42)38(34(37)43,35(26,7)8)18-17-24(5)6/h11-13,16-17,19,26-27,39-40H,14-15,18,20-21H2,1-10H3/t26-,27+,37+,38+/m1/s1
SMILES CC(C)=CC[C@H]1CC23C[C@@H](CC=C(C)C)C(C)(C)[C@@](CC=C(C)C)(C(=O)C(C(=O)c4ccc(O)c(O)c4)=C2OC1(C)C)C3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum enervosum Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia assigu Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia bancana MIQ Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia cambogia Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia dulcis Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia griffithii Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia gummi-gutta Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia indica Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia mangostana Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia ovalifolia Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia pedunculata Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia purpurea Ref.
PlantaeClusiaceae-GuttiferaeMoronobea coccinea Ref.
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OrganismGarcinia cambogia
ReferenceIinuma,Phytochem.,47,(1998),1169