input word = C00044000

Metabolite InformationStructural formula
Name Vibsanin Q
(+)-Vibsanin Q
Formula C26H40O5
Mw 432.28757439
CAS RN 666825-21-4
C_ID C00044000 ,
InChIKey TVVRWBNLBVCRPH-WBGVCNTANA-N
InChICode InChI=1S/C26H40O5/c1-19(2)17-23(28)30-21-12-16-25(5,14-8-13-24(3,4)29-7)15-11-20(18-27)9-10-22-26(21,6)31-22/h8,11-13,16-17,21-22,27H,9-10,14-15,18H2,1-7H3/b13-8+,16-12-,20-11+/t21-,22+,25+,26+/m1/s1
SMILES COC(C)(C)/C=C/CC1(C)/C=C[C@@H](OC(=O)C=C(C)C)C2(C)O[C@H]2CC/C(CO)=CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeViburnum awabuki Ref.
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