6′′-O-Acetylglycitin

CAS Registry Number®

134859-96-4
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CAS Name

6′′-O-Acetylglycitin

Molecular Formula

C24H24O11

Molecular Mass

488.44

Cite this Page

6′′-O-Acetylglycitin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=134859-96-4 (retrieved 2024-04-28) (CAS RN: 134859-96-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H24O11/c1-11(25)32-10-19-21(28)22(29)23(30)24(35-19)34-18-8-16-14(7-17(18)31-2)20(27)15(9-33-16)12-3-5-13(26)6-4-12/h3-9,19,21-24,26,28-30H,10H2,1-2H3/t19-,21-,22+,23-,24-/m1/s1

InChIKey

InChIKey=DUBPGEJGGVZKDD-PFKOEMKTSA-N

SMILES

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

Canonical SMILES

O=C(OCC1OC(OC2=CC=3OC=C(C(=O)C3C=C2OC)C=4C=CC(O)=CC4)C(O)C(O)C1O)C

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-[(6-O-acetyl-β-D-glucopyranosyl)oxy]-3-(4-hydroxyphenyl)-6-methoxy-
  • 7-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-3-(4-hydroxyphenyl)-6-methoxy-4H-1-benzopyran-4-one
  • Glycitein 6′′-O-acetylglucoside
  • 6′′-O-Acetylglycitin
  • Glycitein 7-(6-O-acetyl-β-D-glucopyranoside)

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