AG003LT2

6160-80-1 | 4-Methylumbelliferyl--D-glucuronide

AG003LT2

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CAS Number	6160-80-1
Catalog Number	AG003LT2(AGN-PC-0T103H)
Chemical Name	4-Methylumbelliferyl--D-glucuronide
EC Number	228-186-0
IUPAC Name	(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid
InChI	InChI=1S/C16H16O9/c1-6-4-10(17)24-9-5-7(2-3-8(6)9)23-16-13(20)11(18)12(19)14(25-16)15(21)22/h2-5,11-14,16,18-20H,1H3,(H,21,22)/t11-,12-,13+,14-,16+/m0/s1
InChI Key	ARQXEQLMMNGFDU-JHZZJYKESA-N
MDL Number	MFCD00036772
Molecular Formula	C16H16O9
Molecular Weight	352.2928
SMILES	O[C@H]([C@H]([C@@H]([C@@H](C(O)=O)O1)O)O)[C@@H]1OC2=CC(O3)=C(C=C2)C(C)=CC3=O
Synonyms	4-methylumbelliferyl glucuronide, 4-methylumbelliferyl-beta-D-glucuronide, 4-MUG, hymecromone glucuronide, 6160-80-1, 4-Methylumbelliferyl-beta-D-glucuronide, 4-Methylumbelliferyl glucuronide, 4-Methylumbelliferone glucuronide, MUG trihydrate, 4-Methylumbelliferyl beta-glucuronide, MFCD00036772, MolMap_000057, AC1L3MB1, AC1Q69Y2, CHEBI:1904, ARQXEQLMMNGFDU-JHZZJYKESA-N, (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid, 4-methylumbelliferone beta-d-glucuronide, ST044517, 4-Methylumbelliferyl b-D-glucuronide hydrate, 4-Methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid, (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methyl-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-carboxylic acid, (2S,3S,4S,6S,5R)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yloxy)-2H-3,4,5,6 -tetrahydropyran-2-carboxylic acid, 4-Methylumbelliferyl-beta-D-glucuronide dihydrate, 98%, MUG, EINECS 228-186-0, SCHEMBL110946, CHEMBL1592343, MUG Supplement, for microbiology, (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid, 4-methyl-2-oxo-2h-chromen-7-yl |A-d-glucopyranosiduronic acid, ZINC4073886, BBL102001, STL555799, 4-Methylumbelliferyl |A-D-Glucuronide, AKOS016015769, 4-Methylumbelliferone |A-D-Glucuronide, NCGC00142405-01, AN-21191, 4-Methylumbelliferyl .beta.-D-glucuronide, FT-0619140, C11584, 160M801, W-201743, 4-Methylumbelliferyl-beta-D-glucuronide, >=99.0% (HPLC), 4-Methylumbelliferyl-beta-D-glucopyranosiduronic acid trihydrate, 4-methyl-2-oxo-2H-chromen-7-yl beta-D-glucopyranosiduronic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl-beta-D-glucopyranosiduronic acid, beta-D-Glucopyranosiduronic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl, 4-Methylumbelliferyl iduronide, C16H16O9, CID91553, AR-1G3404, ACN-036857, C16-H16-O9, 4-Methylumbelliferyl b-D-glucuronide trihydrate, 4-Methylumbelliferyl b-D-glucuronide dihydrate, 4-Methylumbelliferyl-|A-D-glucuronic acid dihydrate (MUG), .beta.-D-Glucopyranosiduronic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl, b-D-Glucopyranosiduronic acid,4-methyl-2-oxo-2H-1-benzopyran-7-yl, 4-Methyl-2-oxo-2H-1-benzopyran-7-yl |A-D-Glucopyranosiduronic Acid, ss-D-Glucopyranosiduronic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl, 881005-91-0, 90222-36-9,

Complexity	574
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Exact Mass	352.079g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	352.295g/mol
Monoisotopic Mass	352.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	143A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

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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