input word = C00015738

Metabolite InformationStructural formula
Name Ampelopsin C
Formula C42H32O9
Mw 680.20463262
CAS RN 130518-20-6
C_ID C00015738 ,
InChIKey QDEHKEFWCRAFDN-RJPPMVDKNA-N
InChICode InChI=1S/C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)40-34(20-3-9-24(44)10-4-20)36-29(16-28(48)17-30(36)49)37-39-32(18-31(50)38(33)41(39)40)51-42(37)21-5-11-25(45)12-6-21/h1-18,33-35,37,40,42-50H/t33-,34-,35+,37-,40+,42+/m1/s1
SMILES c12c([C@@H]3c4c5[C@@H]([C@@H]1c1ccc(cc1)O)[C@H]([C@H](c5c(cc4O[C@H]3c1ccc(cc1)O)O)c1ccc(cc1)O)c1cc(cc(c1)O)O)cc(cc2O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeAmpelopsis brevipedunculata var hancei Ref.
PlantaeVitaceaeVitis betulifolia Ref.
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