Met008864: 5,7,3',4'-Tetrahydroxy-6-C-methylflavanone 7-O-glucosdie

Metabolite Information

Name

5,7,3',4'-Tetrahydroxy-6-C-methylflavanone 7-O-glucosdie

IUPAC Name

(2R)-2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

Molecular Formula

C22H24O11

Molecular Weight

464.4

Exact Mass

464.1318616

SMILES

CC1=C(C=C2C(=C1O)C(=O)CC(O2)C3=CC(=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O

InChIKey

FTKJSZFYBZXIDP-WUGZACPFSA-N

InChI

InChI=1S/C22H24O11/c1-8-13(32-22-21(30)20(29)19(28)16(7-23)33-22)6-15-17(18(8)27)12(26)5-14(31-15)9-2-3-10(24)11(25)4-9/h2-4,6,14,16,19-25,27-30H,5,7H2,1H3/t14-,16-,19-,20+,21-,22-/m1/s1