input word = C00044002

Metabolite InformationStructural formula
Name Vibsanin S
(+)-Vibsanin S
Formula C25H38O5
Mw 418.27192432
CAS RN 666825-23-6
C_ID C00044002 ,
InChIKey DKSGHWFSPWAVLA-YOTOWYQANA-N
InChICode InChI=1S/C25H38O5/c1-17(2)15-23(28)29-21-11-14-24(5,13-10-20(27)18(3)4)12-9-19(16-26)7-8-22-25(21,6)30-22/h9,11,14-15,20-22,26-27H,3,7-8,10,12-13,16H2,1-2,4-6H3/b14-11-,19-9+/t20-,21+,22-,24+,25-/m0/s1
SMILES [C@@]12([C@@H](/C=C\[C@@](C/C=C(\CC[C@@H]1O2)/CO)(C)CC[C@@H](C(=C)C)O)OC(=O)C=C(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeViburnum awabuki Ref.
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