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4-methylumbelliferone beta-D-glucuronide

Properties

Image

Occurences in reactions

MNX_ID

MNXM37643

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₆H₁₆O₉

charge

mass

352.07943

reference

chebi:1904

InChIKey

ARQXEQLMMNGFDU-JHZZJYKESA-N

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

SMILES

Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)ccc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:1904 chebi:1904	4-methylumbelliferone beta-D-glucuronide 4-MUG 4-Methylumbelliferone glucuronide 4-Methylumbelliferyl beta-glucuronide 4-Methylumbelliferyl glucuronide 4-methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid
hmdb:HMDB0240464	4-Methylumbelliferone glucuronide (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxochromen-7-yl)oxy]oxane-2-carboxylic acid 4-MUG 4-Methylumbelliferone b-D-glucuronide 4-Methylumbelliferone beta-D-glucuronide 4-Methylumbelliferyl b-glucuronide 4-Methylumbelliferyl beta-glucuronide 4-Methylumbelliferyl glucuronide 4-Methylumbelliferyl-beta-D-glucuronide Hymecromone glucuronide
sabiork.compound:13644 sabiorkM:13644 kegg.compound:C11584 keggC:C11584	4-Methylumbelliferone glucuronide 4-Methylumbelliferyl glucuronide
seed.compound:cpd08401 seedM:cpd08401	4-Methylumbelliferyl glucuronide 4-Methylumbelliferone glucuronide
CHEBI:144582 chebi:144582	4-methylumbelliferone beta-D-glucuronate 4-methyl-2-oxo-2H-chromen-7-yl beta-D-glucopyranosiduronate 4-methylumbelliferone beta-D-glucopyranosiduronate 4-methylumbelliferone beta-D-glucuronide(1-)
keggC:M_C11584 seedM:M_cpd08401	secondary/obsolete/fantasy identifier