input word = C00011342

Metabolite InformationStructural formula
Name Peonidin 3-(4'-arabinosylglucoside)
Formula C27H31O15
Mw 595.16629532
CAS RN 73818-28-7
C_ID C00011342 ,
InChIKey FTIVSPBWRBIYQF-HUMDKSEQNA-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)40-27-23(36)21(34)25(19(8-28)41-27)42-26-22(35)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 COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2OC(CO)[C@@H](O[C@@H]3OC[C@H](O)[C@H](O)C3O)[C@H](O)C2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvolvulaceaeIpomoea fistulosa Ref.
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