input word = C00034004

Metabolite InformationStructural formula
Name Kuguacin E
(+)-Kuguacin E
Formula C27H42O4
Mw 430.30830983
CAS RN 1009344-06-2
C_ID C00034004 ,
InChIKey FGMDCYOFHYPQLK-VCEZNUIVNA-N
InChICode InChI=1S/C27H42O4/c1-16(13-17(2)28)18-9-10-25(6)22-19(29)14-27-20(7-8-21(30)23(27,3)4)26(22,15-31-27)12-11-24(18,25)5/h16,18,20-22,30H,7-15H2,1-6H3/t16-,18-,20+,21+,22+,24-,25+,26-,27-/m1/s1
SMILES CC(=O)CC(C)[C@H]1CC[C@@]2(C)[C@@H]3C(=O)C[C@@]45OC[C@]3(CC[C@]12C)[C@@H]4CC[C@H](O)C5(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
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OrganismMomordica charantia
ReferenceChen,Phytochem.,69,(2008),1043