CAS Registry Number®
552-66-9
CAS Name
Daidzin
Molecular Formula
C21H20O9
Molecular Mass
416.38
Compound Properties
-
Melting Point (1)
215-217 °C (decomp)
Source(s)
- (1) Shibata, Shoji; Yakugaku Zasshi, (1959), 79, 757-60, CAplus
Other Names and Identifiers
InChI
InChI=1S/C21H20O9/c22-8-16-18(25)19(26)20(27)21(30-16)29-12-5-6-13-15(7-12)28-9-14(17(13)24)10-1-3-11(23)4-2-10/h1-7,9,16,18-23,25-27H,8H2/t16-,18-,19+,20-,21-/m1/s1
InChIKey
InChIKey=KYQZWONCHDNPDP-QNDFHXLGSA-N
SMILES
O=C1C=2C(=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=CC2)OC=C1C4=CC=C(O)C=C4
Canonical SMILES
O=C1C(=COC2=CC(OC3OC(CO)C(O)C(O)C3O)=CC=C12)C=4C=CC(O)=CC4
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-
- Daidzin
- 7-(β-D-Glucopyranosyloxy)-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
- Daidzein 7-glucoside
- 7,4′-Dihydroxyisoflavone 7-glucoside
- Daidzoside
- Daidzein 7-O-glucoside
- NPI 031D
- Daidzine
Deleted or Replaced CAS Registry Numbers
1329-08-4, 28572-56-7
