Enterodiol
(2R,3R)-2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diol
Also Known As: Enterodiol|(-)-Enterodiol|rac Enterodiol|Arbo 9|(? currency)-Enterodiol|(2R,3R)-2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diol|4,4',9,9'-Tetrahydroxylignan|Tox21_200247|( inverted exclamation markA)-Enterodiol|TN7345|HY-108695B|NCGC00248577-01|NCGC00257801-01|CAS-80226-00-2|1,4-Butanediol, 2,3-bis((3-hydroxyphenyl)methyl)-, (2R,3R)-
| Molecular Formula | C18H22O4 |
|---|---|
| Molecular Weight | 302.1518 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 80.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.1518 |
| Heavy Atoms | 22 |
| Complexity | 543.6 |
Chemical Identifiers
| CAS Number | 80226-00-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)O)C[C@@H](CO)[C@@H](CC2=CC(=CC=C2)O)CO |
Product Overview
Enterodiol (CAS 80226-00-2), with molecular formula C18H22O4 and molecular weight 302.1518 g/mol. IUPAC: (2R,3R)-2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diol.
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