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biochanin A 7-O-beta-D-glucoside 6''-O-malonate

PropertiesImageOccurences in reactions
MNX_IDMNXM3550Image of MNXM3550
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
formulaC25H22O13
charge-2
mass530.43438
referencechebi:77876
InChIKeyVRCBYTZZZFFKEN-RBZNUJCTSA-L
InChIInChI=1S/C25H24O13/c1-34-12-4-2-11(3-5-12)14-9-35-16-7-13(6-15(26)20(16)21(14)30)37-25-24(33)23(32)22(31)17(38-25)10-36-19(29)8-18(27)28/h2-7,9,17,22-26,31-33H,8,10H2,1H3,(H,27,28)/p-2/t17-,22-,23+,24-,25-/m1/s1
SMILESCOc1ccc(cc1)-c1coc2cc(O[C@@H]3O[C@H](COC(=O)CC([O-])=O)[C@@H](O)[C@H](O)[C@H]3O)cc([O-])c2c1=O
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:77876
chebi:77876
biochanin A 7-O-beta-D-glucoside 6''-O-malonate
3-(4-methoxyphenyl)-5-oxido-4-oxo-4H-chromen-7-yl 6-O-(carboxylatoacetyl)-beta-D-glucopyranoside
biochanin A 7-O-beta-D-glucoside 6''-O-malonate(2-)
kegg.compound:C12625
keggC:C12625
Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
Biochanin A 7-O-beta-D-glucoside 6''-O-malonate
seed.compound:cpd09256
seedM:cpd09256
Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
Biochanin A 7-O-beta-D-glucoside 6''-O-malonate
biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
biochanin A-7-O-glucoside-6''-malonate
CHEBI:28556
chebi:28556
biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside
Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
Biochanin A 7-O-beta-D-glucoside 6''-O-malonate
CHEBI:58577
chebi:58577
biochanin A 7-O-beta-D-glucoside 6''-O-malonate
5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(carboxylatoacetyl)-beta-D-glucopyranoside
metacyc.compound:CPD-4564
metacycM:CPD-4564
biochanin A-7-O-glucoside-6''-malonate
Biochanin A 7-O-beta-D-glucoside 6''-O-malonate
biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)
chebi:20677
chebi:2152
chebi:31287
keggC:M_C12625
seedM:M_cpd09256
secondary/obsolete/fantasy identifier