input word = C00061848

Metabolite InformationStructural formula
Name (2S)-1-[2-[(6-O-D-Apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-4,6-dihydroxyphenyl]-2-methyl-1-butanone
Formula C22H32O13
Mw 504.18429111
CAS RN 467437-62-3
C_ID C00061848
InChIKey MXXCYHQPSVRPOP-MUUUQUSLSA-N
InChICode InChI=1S/C22H32O13/c1-3-9(2)15(26)14-11(25)4-10(24)5-12(14)34-20-18(29)17(28)16(27)13(35-20)6-32-21-19(30)22(31,7-23)8-33-21/h4-5,9,13,16-21,23-25,27-31H,3,6-8H2,1-2H3/t9-,13+,16+,17-,18+,19-,20+,21+,22+/m0/s1
SMILES CCC(C)C(=O)c1c(O)cc(O)cc1OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhyllanthaceaePhyllanthus emblica Ref.
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