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3-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-8-Yl 6-O-(Carboxyacetyl)-beta-D-Glucopyranoside
[CAS# 124590-31-4]

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Identification
Name 3-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-8-Yl 6-O-(Carboxyacetyl)-beta-D-Glucopyranoside
Synonyms 6''-O-MALONYLDAIDZIN
Molecular Structure CAS#: 124590-31-4, 3-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-8-Yl 6-O-(Carboxyacetyl)-beta-D-Glucopyranoside
Molecular Formula C24H22O12
Molecular Weight 502.42
CAS Registry Number 124590-31-4
SMILES c1cc2c(=O)c(coc2c(c1)OC3C(C(C(C(O3)COC(=O)CC(=O)O)O)O)O)c4ccc(cc4)O
InChI 1S/C24H22O12/c25-12-6-4-11(5-7-12)14-9-34-23-13(19(14)29)2-1-3-15(23)35-24-22(32)21(31)20(30)16(36-24)10-33-18(28)8-17(26)27/h1-7,9,16,20-22,24-25,30-32H,8,10H2,(H,26,27)/t16-,20-,21+,22-,24-/m1/s1
InChIKey AKYASNRLFJHNQV-XQKZCQIMSA-N
Properties
Density 1.595g/cm3 (Cal.)
Boiling point 824.812°C at 760 mmHg (Cal.)
Flash point 283.957°C (Cal.)
Refractive index 1.669 (Cal.)
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