2-(β-D-Glucopyranosyloxy)-4-hydroxy-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one

CAS Registry Number®

40246-08-0

CAS Name

2-(β-D-Glucopyranosyloxy)-4-hydroxy-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one

Molecular Formula

C16H21NO11

Molecular Mass

403.34

Cite this Page

2-(β-D-Glucopyranosyloxy)-4-hydroxy-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40246-08-0 (retrieved 2024-11-08) (CAS RN: 40246-08-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H21NO11/c1-24-7-4-3-6-12(13(7)25-2)27-16(14(22)17(6)23)28-15-11(21)10(20)9(19)8(5-18)26-15/h3-4,8-11,15-16,18-21,23H,5H2,1-2H3/t8-,9-,10+,11-,15+,16?/m1/s1

InChIKey

InChIKey=CFUFRWCJGZYVHK-FJDPONSTSA-N

SMILES

O(C)C1=C2C(N(O)C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)=CC=C1OC

Canonical SMILES

O=C1N(O)C2=CC=C(OC)C(OC)=C2OC1OC3OC(CO)C(O)C(O)C3O

Other Names for this Substance

  • 2H-1,4-Benzoxazin-3(4H)-one, 2-(β-D-glucopyranosyloxy)-4-hydroxy-7,8-dimethoxy-
  • 2-(β-D-Glucopyranosyloxy)-4-hydroxy-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one
  • 2-(2,4-Dihydroxy-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one)-β-D-glucopyranoside

CAS INSIGHTSTM
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