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3646-68-2

3646-68-2 structural image
Product Name: D-Glucosamic acid
Formula: C6H13NO6
Synonyms: 2-Amino-2-deoxy-D-gluconic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 141.8 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

COMPUTED DESCRIPTORS

Molecular Weight 195.17 g/mol
XLogP3 -5.9
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 195.07428713 g/mol
Monoisotopic Mass 195.07428713 g/mol
Topological Polar Surface Area 144 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 175
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-amino-2-deoxy-D-gluconic acid is hexanoic acid with four hydroxy groups at C-3, C-4, C-5, C-6, and an amino group at C-2. It has a role as a bacterial metabolite. It is functionally related to a D-gluconic acid. It is a conjugate acid of a 2-amino-2-deoxy-D-gluconate. It is a tautomer of a 2-amino-2-deoxy-D-gluconic acid zwitterion.