input word = C00053215

Metabolite InformationStructural formula
Name Garcinane
Formula C32H52O4
Mw 500.38656015
CAS RN 1054553-55-7
C_ID C00053215
InChIKey XJRXBHNPNHXZKO-PZTKJPEDSA-N
InChICode InChI=1S/C32H52O4/c1-20(34)36-26-23(35)18-29(6)24(28(26,4)5)11-12-31(8)25(29)10-9-21-22-17-27(2,3)13-15-32(22,19-33)16-14-30(21,31)7/h9,22-26,33,35H,10-19H2,1-8H3/t22-,23+,24-,25+,26-,29-,30+,31+,32+/m0/s1
SMILES CC1(C)CC[C@]2(CO)CC[C@@]3(C)[C@]4(C)CC[C@@]5([H])C(C)(C)[C@@H](OC(C)=O)[C@H](O)C[C@]5(C)[C@@]4([H])CC=C3[C@]2([H])C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia polyantha Ref.
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OrganismGarcinia polyantha
ReferenceHemshekhar, M et al., Phytochem Rev., 10, (2011), 325-351.