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4-Methylumbelliferyl-α-D-galactoside

CAT: 0203-23235-14Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0203-23235-14Size:100 mg
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CAS Number
38597-12-5
Applications
Glycosidase substrate
Storage Conditions
R (Refrigerator)
Grade
SP (Specially Prepared Reagent)

Chemical Information

4-Methylumbelliferyl alpha-D-galactopyranoside

4-methylumbelliferyl alpha-D-galactoside is an alpha-D-galactoside having a 4-methylumbelliferyl substituent at the anomeric position. It has a role as a chromogenic compound. It is a member of coumarins, an alpha-D-galactoside and a monosaccharide derivative. It is functionally related to a 4-methylumbelliferone.

CAS Number38597-12-5
PubChem CID2733788
IUPAC Name4-methyl-7-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
Molecular FormulaC16H18O8
Molecular Weight338.31
XLogP-0.8
Topological Polar Surface Area126
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity506
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)O[C@@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O
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
InChIKey
YUDPTGPSBJVHCN-CHUNWDLHSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylumbelliferyl alpha-D-galactopyranoside
CAS: 38597-12-5
CID: 2733788
Formula: C16H18O8
MW: 338.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight338.31
XLogP3-0.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass338.10016753
Monoisotopic Mass338.10016753
Topological Polar Surface Area126 Ų
Heavy Atom Count24
Formal Charge0
Complexity506
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes