input word = C00003385

Metabolite InformationStructural formula
Name Vernodalol
Formula C20H24O8
Mw 392.14711774
CAS RN 65388-17-2
C_ID C00003385 ,
InChIKey FZALQGCQQJLGKE-DDGDXKPONA-N
InChICode InChI=1S/C20H24O8/c1-6-20-7-13(28-17(23)10(2)8-21)14(11(3)18(24)26-5)16(22)15(20)12(4)19(25)27-9-20/h6,13-16,21-22H,1-4,7-9H2,5H3/t13-,14+,15+,16-,20-/m0/s1
SMILES C=C[C@@]12COC(=O)C(=C)[C@@H]1[C@@H](O)[C@H](C(=C)C(=O)OC)[C@@H](OC(=O)C(=C)CO)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDistephanus angulifolius Ref.
PlantaeAsteraceaeVernonia anthelmintica Ref.
PlantaeAsteraceaeVernonia anthemintica Ref.
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OrganismVernonia anthemintica
ReferenceSun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).

Buckingham(Executive Editor), Dictionary of Natural Products, Chapman & Hall, 1994, Vol1-7

1995, Vol8

1996, Vol9

1997, Vol10

1998, Vol11.

Koul, et al., Planta Med, 69, (2003), 164