4-Methylumbelliferyl β-D-xyloside
Properties
- Molecular formula
- C15H16O7
- Molar mass
- 308.29 g/mol
- Exact mass
- 308.0896 Da
- Melting point
- 213–214 °C
- logP
- -0.08Crippen estimate
- Polar surface area
- 109.4 Ų
- H-bond donors / acceptors
- 3 / 7
- Rotatable bonds
- 2
- Stereocentres
- S, R, S, Rin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
6734-33-4SMILES
Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12InChIKey
JWIYLOHVJDJZOQ-KAOXEZKKSA-NInChI
InChI=1S/C15H16O7/c1-7-4-12(17)22-11-5-8(2-3-9(7)11)21-15-14(19)13(18)10(16)6-20-15/h2-5,10,13-16,18-19H,6H2,1H3/t10-,13+,14-,15+/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 2H-1-Benzopyran-2-one, 4-methyl-7-(β-D-xylopyranosyloxy)-
- Coumarin, 4-methyl-7-(β-D-xylopyranosyloxy)-
- 4-Methyl-7-(β-D-xylopyranosyloxy)-2H-1-benzopyran-2-one
- 4-Methylumbelliferyl β-D-xylopyranoside
- 4-Methylumbelliferone-β-D-xyloside
Work with 4-Methylumbelliferyl β-D-xyloside
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
4-Methylumbelliferyl α-L-fucopyranoside54322-38-266 % similar
4-Methylumbelliferyl α-D-glucopyranoside17833-43-166 % similar
4-Methylumbelliferyl β-D-glucopyranoside18997-57-466 % similar
4-Methylumbelliferyl α-D-mannopyranoside28541-83-566 % similar
4-Methylumbelliferyl α-D-galactopyranoside38597-12-566 % similar
4-Methylumbelliferyl β-D-galactopyranoside6160-78-766 % similar
4-Methylumbelliferyl beta-D-glucuronide6160-80-162 % similar
4-Methylumbelliferyl β-cellobioside72626-61-059 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds