AG00IBDQ

64519-82-0 | D-Glucitol, 6-O-a-D-glucopyranosyl-, mixt. with1-O-a-D-glucopyranosyl-D-mannitolOTHER CA INDEX NAMES:D-Mannitol, 1-O-a-D-glucopyranosyl-, mixt. contg.

AG00IBDQ

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CAS Number	64519-82-0
Catalog Number	AG00IBDQ(AGN-PC-0TCVDB)
Chemical Name	D-Glucitol, 6-O-a-D-glucopyranosyl-, mixt. with1-O-a-D-glucopyranosyl-D-mannitolOTHER CA INDEX NAMES:D-Mannitol, 1-O-a-D-glucopyranosyl-, mixt. contg.
IUPAC Name	(3R,4R,5R)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,4,5-pentol
InChI	InChI=1S/C12H24O11/c13-1-4(15)7(17)8(18)5(16)3-22-12-11(21)10(20)9(19)6(2-14)23-12/h4-21H,1-3H2/t4?,5-,6-,7-,8-,9-,10+,11-,12+/m1/s1
InChI Key	SERLAGPUMNYUCK-BLEZHGCXSA-N
MDL Number	MFCD00190708
Molecular Formula	C12H24O11
Molecular Weight	344.3124
SMILES	OCC(O)[C@@H](O)[C@H](O)[C@H](O)CO[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
Synonyms	D-Glucitol, 6-O-alpha-D-glucopyranosyl-, mixt. with 1-O-alpha-D-glucopyranosyl-D-mannitol, D-Glucitol, 6-O-alpha-D-glucopyranosyl-, mixture with 1-O-alpha-D-glucopyranosyl-D-mannitol, isomalt, Palatinit, Isomalt, 64519-82-0, CCRIS 3698, (3R,4R,5R)-6-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexane-1,2,3,4,5-pentaol, 6-O-alpha-D-Glucopyranosyl-D-glucitol mixed with 1-O-alpha-D-glucopyranosyl-D-mannitol, AK396295, AC1MHYA1, SCHEMBL1781066, CHEMBL2104398, DTXSID8020753, CHEBI:140428, D-Glucitol, 6-O-alpha-D-glucopyranosyl-, mixed with 1-O-alpha-D-glucopyranosyl-D-mannitol, D-Glucitol, 6-O-alpha-D-glucopyranosyl-, mixt. with 1-O-alpha-D-glucopyranosyl-D-mannitol, SERLAGPUMNYUCK-BLEZHGCXSA-N, BAY-I-3930, KS-00000FH9, 6-O-alpha-L-allopyranosyl-D-glucitol, AKOS027381801, LS-7463, DS-13958, A4017F7C-EDDD-4444-9BE5-110558E41162, (3R,4R,5R)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,4,5-pentol, Palatinitol, Isomaltitol, Palatinit, Isomaltidex, GalenIQ 980, UNII-S870P55O2W, HSDB 7969, 1-O-alpha-D-Glucopyranosyl-D-mannitol, CID3034828, C12H24O11.C12H24O11, C12-H24-O11.C12-H24-O11, D-Glucitol, 6-O-.alpha.-D-glucopyranosyl-, mixture with 1-O-.alpha.-D-glucopyranosyl-D-mannitol,

Complexity	343
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	8
Defined Bond Stereocenter Count	0
Exact Mass	344.132g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	9
Isotope Atom Count	0
Molecular Weight	344.313g/mol
Monoisotopic Mass	344.132g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	201A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-5.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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