AG00C5P6

3946-01-8 | METHYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE

AG00C5P6

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CAS Number	3946-01-8
Catalog Number	AG00C5P6(AGN-PC-0RJSHH)
Chemical Name	METHYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE
IUPAC Name	N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide
InChI	InChI=1S/C9H17NO6/c1-4(12)10-6-8(14)7(13)5(3-11)16-9(6)15-2/h5-9,11,13-14H,3H2,1-2H3,(H,10,12)/t5-,6-,7-,8-,9-/m1/s1
InChI Key	ZEVOCXOZYFLVKN-JGKVKWKGSA-N
MDL Number	MFCD00069801
Molecular Formula	C9H17NO6
Molecular Weight	235.2344
SMILES	CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(=O)C
Synonyms	3946-01-8, Methyl 2-acetamido-2-deoxy-beta-D-glucopyranoside, Alpha-Methyl-N-Acetyl-D-Glucosamine, Beta-Methyl-N-Acetyl-D-Glucosamine, Methyl 2-acetamido-2-deoxy-b-D-glucopyranoside, N-((2R,3R,4R,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3-yl)acetamide, AC1L9IIR, SCHEMBL1673962, ZEVOCXOZYFLVKN-JGKVKWKGSA-N, ZINC5234411, methyl n-acetyl-beta-d-glucosaminide, MFCD00069801, AKOS002687842, DB04426, N-ACETYL-O-METHYL-D-GLUCOSAMINE, N-acetyl-1-O-methyl-beta-d-glucosamine, 1-O-Methyl-N-acetyl-beta-D-glucosamine, 1NA, AJ-53676, SC-83400, AX8257774, K-0063, W-200584, methyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside, N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide, EAG, MADMP, D0U7DO, CID445750, methyl 2-acetamido-2-deoxy-|A-d-glucopyranoside, METHYL2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE, Methyl 2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-b-D-glucopyranoside, 2-Aminoethyl 2-(Acetylamino)-2-Deoxy-Beta-D-Glucopyranoside, B-D-GLUCOPYRANOSIDE, METHYL2-(ACETYLAMINO)-2-DEOXY-, 2771-48-4, MAG,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Exact Mass	235.106g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	235.236g/mol
Monoisotopic Mass	235.106g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	108A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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