input word = C00032497

Metabolite InformationStructural formula
Name Viteagnusin D
(+)-Viteagnusin D
Formula C20H36O2
Mw 308.27153039
CAS RN 1123613-64-8
C_ID C00032497 ,
InChIKey QNIUYBRZAVVKNV-SSBLJIESNA-N
InChICode InChI=1S/C20H36O2/c1-7-18(5,21)13-14-20(22)15(2)9-10-16-17(3,4)11-8-12-19(16,20)6/h7,15-16,21-22H,1,8-14H2,2-6H3/t15-,16+,18+,19+,20-/m1/s1
SMILES [C@H]1(CC[C@@H]2[C@@]([C@]1(CC[C@@](C=C)(C)O)O)(CCCC2(C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeVitex agnus-castus Ref.
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OrganismVitex agnus-castus
ReferenceOno,Chem.Pharm.Bull.,56,(2008),1621