input word = C00057745

Metabolite InformationStructural formula
Name Vitisinol E
Formula C29H26O7
Mw 486.16785319
CAS RN 1022106-23-5
C_ID C00057745
InChIKey NJKMFUYYGNGQBI-VWIBZWLUSA-N
InChICode InChI=1S/C29H26O7/c1-36-29(35)28-19(5-2-17-3-8-21(30)9-4-17)12-25(34)16-26(18-6-10-22(31)11-7-18)27(28)20-13-23(32)15-24(33)14-20/h2-15,26-28,30-33H,16H2,1H3/b5-2+/t26-,27-,28+/m1/s1
SMILES COC(=O)[C@H]1C(/C=C/c2ccc(O)cc2)=CC(=O)C[C@H](c2ccc(O)cc2)[C@H]1c1cc(O)cc(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis amurensis Ref.
PlantaeVitaceaeVitis betulifolia Ref.
PlantaeVitaceaeVitis chunganensis Ref.
PlantaeVitaceaeVitis coignetiae Ref.
PlantaeVitaceaeVitis heyneana Ref.
PlantaeVitaceaeVitis thunbergii Ref.
PlantaeVitaceaeVitis vinifera Ref.
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