input word = C00032031

Metabolite InformationStructural formula
Name Moreollic acid
Formula C34H40O9
Mw 592.26723288
CAS RN 173792-68-2
C_ID C00032031 ,
InChIKey YWPUDSYPVZVGNW-IDOISQTKNA-N
InChICode InChI=1S/C34H40O9/c1-16(2)9-10-19-26-18(12-13-31(4,5)41-26)24(35)22-25(36)23-28(40-8)20-15-21-32(6,7)43-33(29(20)37,14-11-17(3)30(38)39)34(21,23)42-27(19)22/h9,11-13,20-21,23,28,35H,10,14-15H2,1-8H3,(H,38,39)/b17-11-/t20-,21-,23+,28-,33-,34-/m0/s1
SMILES c12c(C(=O)[C@H]3[C@]4(O1)[C@@]1(C(=O)[C@H]([C@@H]3OC)C[C@H]4C(O1)(C)C)C/C=C(/C)\C(=O)O)c(c1c(c2CC=C(C)C)OC(C=C1)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia hanburyi Ref.
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