AG00IBJR

66009-10-7 | D(+)-Melibiose monohydrate

AG00IBJR

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CAS Number	66009-10-7
Catalog Number	AG00IBJR(AGN-PC-0TJ0PQ)
Chemical Name	D(+)-Melibiose monohydrate
IUPAC Name	(2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal;hydrate
InChI	InChI=1S/C12H22O11.H2O/c13-1-4(15)7(17)8(18)5(16)3-22-12-11(21)10(20)9(19)6(2-14)23-12;/h1,4-12,14-21H,2-3H2;1H2/t4-,5+,6+,7+,8+,9-,10-,11+,12-;/m0./s1
InChI Key	CHIDEFLSUMQFBY-CQIZOMOZSA-N
MDL Number	MFCD00168065
Molecular Formula	C12H24O12
Molecular Weight	360.3118
SMILES	O=C[C@H](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.[H]O[H]
Synonyms	66009-10-7, D(+)-MELIBIOSE MONOHYDRATE, 10030-63-4, D(+)-Melibiose monohydrate, 99+%, MFCD00198188, 6-O-ALPHA-D-GALACTOPYRANOSYL-D-GLUCOSE MONOHYDRATE, D-Melibiose hydrate, D-(+)-Melibiose hydrate, 585-99-9 (anhydrous), Melibiose, >=98% (HPLC), (2R,3S,4R,5R)-2,3,4,5-Tetrahydroxy-6-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexanal hydrate, 6025AF, AKOS027381802, 6-|A-D-Galactopyranosyl-D-glucopyranose, FT-0621291, K-0163, 6-O-(a-D-Galactopyranosyl)-D-glucopyranose hydrate, 6-O-A-D-GALACTOPYRANOSYL-D-GLUCOSE MONOHYDRATE, 6-O-(a-D-Galactopyranosyl)-D-glucopyranose monohydrate, melibiose, Melibiose, monohydrate, D-Melibiose monohydrate, |A-D-Melibiose hydrate, alpha-D-Melibiose hydrate, C12H22O11.H2O, D( )Melibiose for bacteriology 1gm, 6-O-alpha-D-Galactopyranosyl-D-glucose, 6-alpha-D-Galactopyranosyl-D-glucopyranose, D-Glucose, 6-O-.alpha.-D-galactopyranosyl-, monohydrate, D-Glucopyranose, 6-O-.alpha.-D-galactopyranosyl-, monohydrate, (2R,3R,4S,5S,6R)-6-((((2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2,3,4,5-tetraol hydrate, 585-99-9,

Complexity	367
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	9
Defined Bond Stereocenter Count	0
Exact Mass	360.127g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	9
Isotope Atom Count	0
Molecular Weight	360.312g/mol
Monoisotopic Mass	360.127g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	198A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
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Certificate of Analysis

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