β-N-Acetylglucosamine
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β-N-Acetylglucosamine
structure -
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CAS No:
14131-68-1
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Formula:
C8H15NO6
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Chemical Name:
β-N-Acetylglucosamine
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Synonyms:
β-D-Glucopyranose,2-(acetylamino)-2-deoxy-;Glucopyranose,2-acetamido-2-deoxy-,β-D-;2-(Acetylamino)-2-deoxy-β-D-glucopyranose;2-Acetamido-2-deoxy-β-D-glucopyranose;2-Acetamido-2-deoxy-β-D-glucose;β-N-Acetyl-D-glucosamine;2-Deoxy-2-acetamido-β-D-glucopyranose;N-Acetyl-β-D-glucosamine;β-N-Acetylglucosamine;28905-08-0;53585-05-0;1569887-10-0
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CAS No:
Description
Solid
Chitin is an aminoglycan consisting of beta-(1->4)-linked N-acetyl-D-glucosamine residues. It has a role as a vulnerary, a human metabolite, a Saccharomyces cerevisiae metabolite and a mouse metabolite. It is an aminoglycan and a N-acylglucosamine.|The N-acetyl derivative of glucosamine.
β-N-Acetylglucosamine Basic Attributes
220.22
221.21
8P59336F68
DTXSID3045855|DTXSID6058683|DTXSID6040450|DTXSID9041158
Characteristics
125.04000
-2.314 (est)
1.50±0.1 g/cm3(Predicted)
182-183.5 °C
595.4±50.0 °C(Predicted)
313.9ºC
1.575
1e+006 mg/L @ 25 °C (est)
153 Ų [M+Na]+ [CCS Type: TW, Method: calibrated with polyalanine]|150.7 Ų [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|157.8 Ų [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|152.5 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|153.5 Ų [M+Na]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]|153.1 Ų [M-H]-
β-N-Acetylglucosamine Use and Manufacturing
Poly(oxy-1,2-ethanediyl), .alpha.-(carboxymethyl)-.omega.-(dinonylphenoxy)-, branched: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:221.21
XLogP3:-1.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:221.08993720
Monoisotopic Mass:221.08993720
Topological Polar Surface Area:119
Heavy Atom Count:15
Complexity:235
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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