input word = C00014854

Metabolite InformationStructural formula
Name Peonidin 3-[2-(xylosyl)galactoside]
Formula C27H31O15
Mw 595.16629532
CAS RN 155380-00-0
C_ID C00014854 ,
InChIKey PYUGATAPBPHGFK-JIHVSOTFNA-O
InChICode InChI=1S/C27H30O15/c1-37-17-4-10(2-3-13(17)30)24-18(7-12-14(31)5-11(29)6-16(12)39-24)40-27-25(22(35)21(34)19(8-28)41-27)42-26-23(36)20(33)15(32)9-38-26/h2-7,15,19-23,25-28,32-36H,8-9H2,1H3,(H2-,29,30,31)/p+1/t15-,19+,20-,21+,22+,23-,25+,26+,27-/m1/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O[C@H]1[C@@H]([C@@H]([C@@H](CO1)O)O)O)c1cc(c(cc1)O)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeAralia cordata Ref.
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