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Home > Encyclopedia > 2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one structure

2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one 

structure
  • CAS No:

    17622-26-3

  • Formula:

    C15H19NO9

  • Chemical Name:

    2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

  • Synonyms:

    2H-1,4-Benzoxazin-3(4H)-one,2-(β-D-glucopyranosyloxy)-7-methoxy-;Glucopyranoside,3,4-dihydro-7-methoxy-3-oxo-2H-1,4-benzoxazin-2-yl;2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one;2-(2-Hydroxy-7-methoxy-1,4(2H)-benzoxazin-3(4H)-one)-β-D-glucopyranoside

Description

HMBOA beta-D-glucoside is a beta-D-glucoside derived from 2-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine. It has a role as a mouse metabolite and a rat metabolite. It is a beta-D-glucoside, a benzoxazine, an aromatic ether and a monosaccharide derivative. It derives from a HBOA.

2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one Basic Attributes

357.31 g/mol

357.31

Characteristics

147 Ų

-1.69330

228-235 °C

Drug Information

2-O-glucosyl-7-methoxy-1,4(2H)-benzoxazin-3-one

Computed Properties

Molecular Weight:357.31
XLogP3:-1.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:357.10598118
Monoisotopic Mass:357.10598118
Topological Polar Surface Area:147
Heavy Atom Count:25
Complexity:478
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-(β-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

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