2-(Hydroxymethyl)-6-(4-methoxyphenoxy)tetrahydropyran-3,4,5-triol
2-(hydroxymethyl)-6-(4-methoxyphenoxy)oxane-3,4,5-triol
Also Known As: Methylarbutin|4-Methoxyphenyl hexopyranoside|p-Methoxyphenyl b-D-glucoside|p-Methoxyphenyl b-D-galactoside|4-Methoxyphenyl beta-D-Galactopyranoside|4-Methoxyphenyl beta-D-Glucopyranoside|4-Methoxyphenyl a-D-mannopyranoside|4-Methoxyphenyl b-D-glucopyranoside|p-Methoxyphenyl beta-D-glucoside|4-Methoxyphenyl b-D-galactopyranoside|p-Methoxyphenyl beta-D-galactoside|4-Methoxyphenyl alpha-D-Mannopyranoside|4-Methoxyphenylalpha-D-Mannopyranoside|NCI60_022945|2-(hydroxymethyl)-6-(4-methoxyphenoxy)oxane-3,4,5-triol|S07-0085|S07-0086|2-(hydroxymethyl)-6-(4-methoxyphenoxy)tetrahydropyran-3,4,5-triol|(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-methoxyphenoxy)oxane-3,4,5-triol|(2R,3S,4S,5S,6R)-2-(HYDROXYMETHYL)-6-(4-METHOXYPHENOXY)OXANE-3,4,5-TRIOL|Methylarbutin, 4-Methoxyphenylglucoside, MolPort-003-984-013, CID80131, ZINC05733445, 4-Methoxyphenyl beta-D-Glucopyranoside, p-Methoxyphenyl beta-D-glucopyranoside, beta-D-Glucopyranoside, 4-methoxyphenyl, M1631, C17599, 6032-32-2
| Molecular Formula | C13H18O7 |
|---|---|
| Molecular Weight | 286.10526 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.10526 |
| Monoisotopic Mass | 286.10526 |
| Heavy Atoms | 20 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 28541-75-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O |
| InChIKey | SIXFVXJMCGPTRB-UHFFFAOYSA-N |
Product Overview
2-(Hydroxymethyl)-6-(4-methoxyphenoxy)tetrahydropyran-3,4,5-triol (CAS 28541-75-5), with molecular formula C13H18O7 and molecular weight 286.10526 g/mol. IUPAC: 2-(hydroxymethyl)-6-(4-methoxyphenoxy)oxane-3,4,5-triol.