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Chemical structure of 4-Methylumbelliferyl-N,N-diacetylchitobioside

GC42446

4-Methylumbelliferyl-N,N-diacetylchitobioside

Also listed as 4-Methylumbelliferyl β-D-N,N'-diacetylchitobioside

4-Methylumbelliferyl β-D-N,N'-diacetylchitobioside (4-μU-(GlcNAc)2) is a fluorogenic substrate for chitinases and chitobiosidases

ChemicalCAS53643-12-2MW582.6FormulaC26H34N2O13
CAS number
53643-12-2
Molecular weight
582.6
Formula
C26H34N2O13
Solubility
DMF： 10 mg/ml,DMSO： 10 mg/ml
InChIKey
UPSFMJHZUCSEHU-JYGUBCOQSA-N
Catalogue number
GC42446
Brand
GLPBIO
Computed properties PubChem CID 171284 · XLogP -2.9 · TPSA 223 Ų · H-bond donors 7
XLogP
-2.9
TPSA
223 Ų
H-bond donors
7
H-bond acceptors
13
Rotatable bonds
8
Heavy atoms
41

SMILES CC1=CC(=O)OC2=C1C=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)NC(=O)C)O)NC(=O)C

Computed descriptors from PubChem (CID 171284), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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