input word = C00044377

Metabolite InformationStructural formula
Name Vilmorinine C
(+)-Vilmorinine C
Formula C20H24O8
Mw 392.14711774
CAS RN 211802-28-7
C_ID C00044377 ,
InChIKey HEARPDWGNHOTSL-UZFKJDNNNA-N
InChICode InChI=1S/C20H24O8/c1-8-4-12(21)16(24)19(3)10(8)5-13-20(7-27-18(26)15(19)20)11(6-14(22)23)9(2)17(25)28-13/h4,9-11,13,15-16,24H,5-7H2,1-3H3,(H,22,23)/t9-,10+,11+,13-,15-,16-,19+,20-/m1/s1
SMILES CC1=CC(=O)[C@@H](O)[C@]2(C)[C@H]3C(=O)OC[C@@]34[C@@H](C[C@@H]12)OC(=O)[C@H](C)[C@@H]4CC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaeAilanthus vilmoriniana Ref.
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