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Formononetin 7-(6''-methylmalonylglucoside)

Properties

Image

Occurences in reactions

MNX_ID

MNXM125746

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₆H₂₆O₁₂

charge

mass

530.14243

reference

hmdb:HMDB0029494

InChIKey

DQNRUSGVMUYAHO-UHFFFAOYSA-N

InChI

InChI=1S/C26H26O12/c1-33-14-5-3-13(4-6-14)17-11-35-18-9-15(7-8-16(18)22(17)29)37-26-25(32)24(31)23(30)19(38-26)12-36-21(28)10-20(27)34-2/h3-9,11,19,23-26,30-32H,10,12H2,1-2H3

SMILES

COC(=O)CC(=O)OCC1OC(Oc2ccc3c(=O)c(-c4ccc(OC)cc4)coc3c2)C(O)C(O)C1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0029494	Formononetin 7-(6''-methylmalonylglucoside) 1-Methyl 3-(3,4,5-trihydroxy-6-{[3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-2-yl)methyl propanedioic acid 1-methyl 3-(3,4,5-trihydroxy-6-{[3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-2-yl)methyl propanedioate 1-methyl 3-(3,4,5-trihydroxy-6-{[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl)methyl propanedioate
hmdb:HMDB29494	secondary/obsolete/fantasy identifier