input word = C00012147

Metabolite InformationStructural formula
Name Niveusin B
Formula C20H26O7
Mw 378.16785319
CAS RN 75680-25-0
C_ID C00012147 ,
InChIKey IWAWQWJSLDZVRM-HCJAHIDQNA-N
InChICode InChI=1S/C20H26O7/c1-5-11(2)17(22)26-15-9-19(4)6-7-20(24,27-19)13(10-21)8-14-16(15)12(3)18(23)25-14/h5,8,14-16,21,24H,3,6-7,9-10H2,1-2,4H3/b11-5-,13-8-/t14-,15+,16-,19-,20+/m0/s1
SMILES [C@]12(C[C@H]([C@@H]3[C@H](/C=C(\[C@@](CC1)(O2)O)/CO)OC(=O)C3=C)OC(=O)/C(=C\C)/C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeAsteraceaeHelianthus niveus Ref.
PlantaeAsteraceaeViguiera quinqueremis Blake Ref.
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