input word = C00050407

Metabolite InformationStructural formula
Name Vignaticol
Formula C20H32O6
Mw 368.21988875
CAS RN 196090-80-9
C_ID C00050407 ,
InChIKey VBKHTSMCQKCAJR-BQJKSACHNA-N
InChICode InChI=1S/C20H32O6/c1-10(2)17(22)9-18(23)14(4)8-19(24)15(17,5)20(18,25)13(26-19)12-11(3)6-7-16(12,14)21/h10-13,21-25H,6-9H2,1-5H3/t11-,12+,13-,14+,15-,16-,17+,18-,19+,20-/m1/s1
SMILES [C@@]12([C@@]3([C@@]4([C@H]([C@@H]5[C@]1([C@]([C@@](O)(C(C)C)C2)([C@](C3)(O5)O)C)O)[C@@H](CC4)C)O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaePersea indica Ref.
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