Glycitin

CAS Registry Number®

40246-10-4

CAS Name

Glycitin

Molecular Formula

C22H22O10

Molecular Mass

446.40

Cite this Page

Glycitin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40246-10-4 (retrieved 2024-11-22) (CAS RN: 40246-10-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    203-204 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H22O10/c1-29-15-6-12-14(30-9-13(18(12)25)10-2-4-11(24)5-3-10)7-16(15)31-22-21(28)20(27)19(26)17(8-23)32-22/h2-7,9,17,19-24,26-28H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1

InChIKey

InChIKey=OZBAVEKZGSOMOJ-MIUGBVLSSA-N

SMILES

O=C1C=2C(=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(OC)C2)OC=C1C4=CC=C(O)C=C4

Canonical SMILES

O=C1C(=COC=2C=C(OC3OC(CO)C(O)C(O)C3O)C(OC)=CC12)C=4C=CC(O)=CC4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-6-methoxy-
  • 7-(β-D-Glucopyranosyloxy)-3-(4-hydroxyphenyl)-6-methoxy-4H-1-benzopyran-4-one
  • Glycitein 7-O-β-glucoside
  • Glycitein 7-O-glucoside
  • Glycitein-7-β-O-glucoside

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