input word = C00055872

Metabolite InformationStructural formula
Name Garciniacowol
Formula C54H78O4
Mw 790.59001098
CAS RN 1458024-01-5
C_ID C00055872
InChIKey NIFLRRSDLRPDRE-MWTZQSHUSA-N
InChICode InChI=1S/C54H78O4/c1-37(2)19-13-21-39(5)23-15-25-41(7)27-17-31-53(11)33-29-45-49(57-53)35-47(55)43(9)51(45)52-44(10)48(56)36-50-46(52)30-34-54(12,58-50)32-18-28-42(8)26-16-24-40(6)22-14-20-38(3)4/h19-20,23-24,27-28,35-36,55-56H,13-18,21-22,25-26,29-34H2,1-12H3/b39-23+,40-24+,41-27+,42-28+
SMILES CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC1(C)CCc2c(cc(O)c(C)c2-c2c(C)c(O)cc3c2CCC(C)(CC/C=C(C)CC/C=C(C)CCC=C(C)C)O3)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia cowa Ref.
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