input word = C00052979

Metabolite InformationStructural formula
Name Cipaferen H
Formula C32H44O11
Mw 604.28836225
CAS RN 1542240-18-5
C_ID C00052979
InChIKey LHLVFYJXGDXMJF-ZMVZBWNJSA-N
InChICode InChI=1S/C32H44O11/c1-9-15(2)27(37)42-23-24(36)29(4,5)19(13-20(33)39-8)31(7)18-10-11-30(6)25(17-12-21(34)41-28(17)38)40-22(35)14-32(30,16(18)3)43-26(23)31/h12,15,18-19,21,23-26,34,36H,3,9-11,13-14H2,1-2,4-8H3/t15?,18-,19-,21?,23-,24-,25-,26-,30-,31+,32-/m0/s1
SMILES C=C1[C@@H]2CC[C@@]3(C)[C@H](C4=CC(O)OC4=O)OC(=O)C[C@@]13O[C@H]1[C@@H](OC(=O)C(C)CC)[C@H](O)C(C)(C)[C@H](CC(=O)OC)[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCipadessa baccifera Ref.
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