input word = C00003386

Metabolite InformationStructural formula
Name Vernoflexin
Vernoflexine
Zaluzanin C senecioate
Formula C20H24O4
Mw 328.16745925
CAS RN 57576-43-9
C_ID C00003386 ,
InChIKey CEKDWOBPPFOCDL-VTJZKLMFNA-N
InChICode InChI=1S/C20H24O4/c1-10(2)8-17(21)23-16-9-15-11(3)6-7-14-12(4)20(22)24-19(14)18(15)13(16)5/h8,14-16,18-19H,3-7,9H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
SMILES [C@@H]12[C@@H]([C@@H]3[C@@H](CCC1=C)C(=C)C(=O)O3)C(=C)[C@H](C2)OC(=O)C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeVernonia arkansana Ref.
PlantaeAsteraceaeVernonia chinense Ref.
PlantaeAsteraceaeVernonia chinensis Ref.
PlantaeAsteraceaeVernonia flexuosa Ref.
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OrganismVernonia flexuosa
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter51