AG0032V0

3006-60-8 | 2-(Acetylamino)-2-deoxy-beta-D-galactopyranose 1,3,4,6-tetraacetate

AG0032V0

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CAS Number	3006-60-8
Catalog Number	AG0032V0(AGN-PC-0R5EJC)
Chemical Name	2-(Acetylamino)-2-deoxy-beta-D-galactopyranose 1,3,4,6-tetraacetate
IUPAC Name	[(2R,3R,4R,5R,6S)-5-acetamido-3,4,6-triacetyloxyoxan-2-yl]methyl acetate
InChI	InChI=1S/C16H23NO10/c1-7(18)17-13-15(25-10(4)21)14(24-9(3)20)12(6-23-8(2)19)27-16(13)26-11(5)22/h12-16H,6H2,1-5H3,(H,17,18)/t12-,13-,14+,15-,16-/m1/s1
InChI Key	OVPIZHVSWNOZMN-IBEHDNSVSA-N
MDL Number	MFCD00214297
Molecular Formula	C16H23NO10
Molecular Weight	389.3545
SMILES	CC(=O)OC[C@H]1O[C@@H](OC(=O)C)[C@@H]([C@H]([C@H]1OC(=O)C)OC(=O)C)NC(=O)C
Synonyms	3006-60-8, (2S,3R,4R,5R,6R)-3-Acetamido-6-(acetoxymethyl)tetrahydro-2H-pyran-2,4,5-triyl triacetate, 2-ACETAMIDO-1,3,4,6-TETRA-O-ACETYL-2-DEOXY-B-D-GALACTOPYRANOSE, beta-D-Galactosamine pentaacetate, OVPIZHVSWNOZMN-IBEHDNSVSA-N, AK110070, 2-Acetamido-1,3,4,6-tetra-O-acetyl-2-deoxy-beta-D-galactopyranose, 2-Acetamido-2-deoxy-1,3,4,6-tetra-O-acetyl-beta-D-glucopyranose, BICL4239, SCHEMBL2288412, 2-(Acetylamino)-2-deoxy-beta-D-galactopyranose 1,3,4,6-tetraacetate, CTK9A5773, 2-Acetamido-1,3,4,6-tetrakis-(O-acetyl)-2-deoxy-D-galactospyranose, MFCD00214297, ZINC22046472, [(2R,3R,4R,5R,6S)-5-acetamido-3,4,6-triacetyloxyoxan-2-yl]methyl acetate, AKOS015841027, AKOS015902933, CS-W005729, DS-4512, SC-40663, AB0069008, AX8224993, ST24020281, M-7862, W-202246, 2-Acetamido-1,3,4,6-tetra-O-acetyl-2-deoxy-b-D-gal, 1-O,3-O,4-O,6-O-Tetraacetyl-2-(acetylamino)-2-deoxy-beta-D-galactopyranose, (2S,3R,4R,5R,6R)-3-Acetamido-6-(acetoxymethyl)-tetrahydro-2H-pyran-2,4,5-triyl triacetate, acetic acid (2S,3R,4R,5R,6R)-4,5-diacetoxy-6-acetoxymethyl-3-acetylamino-tetrahydro-pyran-2-yl ester, b-D-Galactosamine pentaacetate, ?-d-galactosamine pentaacetate, AC1O7531, NSC232059, CID6547253, beta(c)\D(c)\Galactosamine pentaacetate, N-Acetyl-beta-D-glucosamine tetraacetate, AJ-80752, CJ-17281, I14-19714, 2-Acetamido-1,3,4,6-tetra-O-acetyl-2-deoxy--D-galactopyranose, (2S,3R,4R,5R,6R)-3-Acetamido-6-(acetoxymethyl)tetrahydro-2H-pyran-2,4,5-triyltriacetate, 7772-79-4,

Complexity	604
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Exact Mass	389.132196g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	389.35g/mol
Monoisotopic Mass	389.132196g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	144Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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