AG00C0PH

38597-12-5 | 4-Methylumbelliferyl-alpha-D-galactopyranoside

AG00C0PH

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CAS Number	38597-12-5
Catalog Number	AG00C0PH(AGN-PC-0RGZG6)
Chemical Name	4-Methylumbelliferyl-alpha-D-galactopyranoside
EC Number	254-031-1
IUPAC Name	4-methyl-7-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
InChI	InChI=1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13+,14+,15-,16+/m1/s1
InChI Key	YUDPTGPSBJVHCN-CHUNWDLHSA-N
MDL Number	MFCD03791284
Molecular Formula	C16H18O8
Molecular Weight	338.3093
SMILES	O[C@H]([C@H]([C@H]([C@@H](CO)O1)O)O)[C@H]1OC2=CC(O3)=C(C=C2)C(C)=CC3=O
Synonyms	4-methylumbelliferone-alpha-D-galactoside, 4-methylumbelliferyl galactose, 4-methylumbelliferyl-alpha-D-galactopyranoside, 4-methylumbelliferyl-beta-D-galactopyranoside, 4-methylumbelliferyl-beta-D-galactoside, 4-methylumbelliferyl-galactopyranoside, 4-methylumbelliferyl-galactopyranoside, ((alpha-D)-galactopyranosyloxy)-isomer, 4-methylumbelliferyl-galactopyranoside, ((beta-D)-galactosyloxy)-isomer, 4-MUBF-GP, 38597-12-5, 4-Methylumbelliferyl-alpha-D-galactopyranoside, 4-Methylumbelliferyl a-D-galactopyranoside, 7-(alpha-D-Galactopyranosyloxy)-4-methyl-2H-1-benzopyran-2-one, 4-Methyl-7-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-2H-chromen-2-one, AC1MBZOL, 4-methylumbelliferyl-a-d-galactopyranoside, SCHEMBL308095, CHEBI:91115, BIM1094, ZX-AFC000145, 4-methyl-7-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one, ZINC4282235, GC5401, MFCD00063278, AKOS015897095, 4-methylumbelliferyl alpha-d-galactoside, FT-0619134, W0255, 4-Methylumbelliferyl alpha-D-galactopyranoside, I07-365, 4-Methylumbelliferyl-alpha-D-galactopyranoside hydrate, 99%, 4-methyl-2-oxo-2H-1-benzopyran-7-yl alpha-D-galactopyranoside, 4-Methylumbelliferyl alpha-D-galactopyranoside, >=98% (TLC), 2H-1-Benzopyran-2-one, 7-(alpha-D-glucopyranosyloxy)-4-methyl-, 4-methyl-7-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-2-one, MU-alpha-GAL, 4-Methylumbelliferyl glucoside, C16H18O8, YUDPTGPSBJVHCN-CHUNWDLHSA-N, EINECS 254-031-1, C16-H18-O8, CID2733788, 4-Methylumbelliferyl alpha-D-glucopyranoside, 4-Methylumbelliferyl alpha-D-galactopyranoside, 98% - 100MG 100mg, 17833-43-1,

Complexity	506
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Exact Mass	338.1g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	338.312g/mol
Monoisotopic Mass	338.1g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	126A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
UN Code

Certificate of Analysis

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