input word = C00062904

Metabolite InformationStructural formula
Name Peonidin-3-O-(6-O-acetyl)-glucoside
Formula C24H25O12
Mw 505.13460127
CAS RN 751447-22-0
C_ID C00062904
InChIKey MBSKDCPWFSMEFD-WKKMNAASSA-O
InChICode InChI=1S/C24H24O12/c1-10(25)33-9-19-20(29)21(30)22(31)24(36-19)35-18-8-13-15(28)6-12(26)7-16(13)34-23(18)11-3-4-14(27)17(5-11)32-2/h3-8,19-22,24,29-31H,9H2,1-2H3,(H2-,26,27,28)/p+1/t19-,20-,21+,22-,24-/m1/s1
SMILES COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2OC(COC(C)=O)C(O)C(O)C2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeMangifera indica Ref.
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