input word = C00047422

Metabolite InformationStructural formula
Name Cineracipadesin E
(-)-Cineracipadesin E
Formula C33H42O13
Mw 646.26254143
CAS RN 1146121-00-7
C_ID C00047422 ,
InChIKey DJJRPKGUHQDXNB-JFMUBGSMNA-N
InChICode InChI=1S/C33H42O13/c1-16-32-14-24(38)45-26(20-10-11-41-15-20)30(32,7)13-22(42-17(2)34)33(16,39)31(8)21(12-23(37)40-9)29(5,6)27(44-19(4)36)25(28(31)46-32)43-18(3)35/h10-11,15,21-22,25-28,39H,1,12-14H2,2-9H3/t21-,22+,25-,26-,27+,28-,30-,31+,32-,33-/m0/s1
SMILES C=C1[C@@]23CC(=O)O[C@@H](c4ccoc4)[C@]2(C)C[C@@H](OC(C)=O)[C@]1(O)[C@@]1(C)[C@@H](O3)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C(C)(C)[C@@H]1CC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCipadessa cinerascens Ref.
zoom in