AG003TFZ

22352-19-8 | b-D-Maltose octaacetate

AG003TFZ

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CAS Number	22352-19-8
Catalog Number	AG003TFZ(AGN-PC-0QYX1O)
Chemical Name	b-D-Maltose octaacetate
EC Number	606-994-8
IUPAC Name	[(2R,3R,4S,5R,6S)-4,5,6-triacetyloxy-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
InChI	InChI=1S/C28H38O19/c1-11(29)37-9-19-21(39-13(3)31)23(40-14(4)32)26(43-17(7)35)28(46-19)47-22-20(10-38-12(2)30)45-27(44-18(8)36)25(42-16(6)34)24(22)41-15(5)33/h19-28H,9-10H2,1-8H3/t19-,20-,21-,22-,23+,24+,25-,26-,27-,28-/m1/s1
InChI Key	WOTQVEKSRLZRSX-QACPWNKNSA-N
MDL Number	MFCD00079432
Molecular Formula	C28H38O19
Molecular Weight	678.5899
SMILES	CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1O[C@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O
Synonyms	b-D-Maltose octaacetate, 22352-19-8, octaacetyl-beta-maltose, Beta-D-maltose octaacetate, Octaacetyl beta-maltose, Maybridge1_004338, AC1O8K5I, SCHEMBL424516, HMS553N06, ZINC97994617, AKOS016009417, MCULE-3292130269, AS-39886, (2S,3R,4S,5R,6R)-6-(acetoxymethyl)-5-(((2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2,3,4-triyl triacetate, [(2R,3R,4S,5R,6S)-4,5,6-triacetyloxy-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate, Cyclooctaamylose, ?-D-Maltose Octaacetate, Maltose, octaacetate, .beta.-, ACN-041296, CID6710817, beta-D-Glucopyranose, 4-O-(2,3,4,6-tetra-O-acetyl-alpha-D-glucopyranosyl)-, tetraacetate, .beta.-D-Glucopyranose, 4-O-(2,3,4,6-tetra-O-acetyl-.alpha.-D-glucopyranosyl)-, tetraacetate,

Complexity	1200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	10
Defined Bond Stereocenter Count	0
Exact Mass	678.201g/mol
Formal Charge	0
Heavy Atom Count	47
Hydrogen Bond Acceptor Count	19
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	678.593g/mol
Monoisotopic Mass	678.201g/mol
Rotatable Bond Count	20
Topological Polar Surface Area	238A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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