input word = C00029963

Metabolite InformationStructural formula
Name Cipadesin D
Formula C31H40O11
Mw 588.25706212
CAS RN 942480-24-2
C_ID C00029963 ,
InChIKey XRRWVGIPDVQIEG-MNBISPTJNA-N
InChICode InChI=1S/C31H40O11/c1-16-30-14-25(35)41-26(19-9-10-38-15-19)28(30,6)13-23(40-18(3)33)31(16,36)29(7)20(11-24(34)37-8)27(4,5)21(39-17(2)32)12-22(29)42-30/h9-10,15,20-23,26,36H,1,11-14H2,2-8H3/t20-,21+,22-,23-,26-,28-,29+,30-,31-/m0/s1
SMILES C=C1C23CC(=O)O[C@@H](c4ccoc4)[C@]2(C)C[C@H](OC(C)=O)[C@]1(O)[C@@]1(C)[C@H](C[C@@H](OC(C)=O)C(C)(C)[C@@H]1CC(=O)OC)O3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCipadessa cinerascens Ref.
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