Sequoyitol
(1R,2S,4R,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
Also Known As: Sequoyitol|5-O-Methyl-myo-inositol|D-Pinitol|Pinitol|1D-5-O-Methyl-myo-inositol|O-Methyl-scyllo-inositol|1-O-Methyl-scyllo-inositol|D-3-O-methylinositol|2-O-Methyl-myo-inositol|6-O-Methyl-myo-inositol|myo-Inositol, 5-O-methyl-|bmse000740|2-o-methyl-d-myo-inositol|scyllo-inositol methyl ether|1D-6-O-Methyl-myo-inositol|EINECS 208-352-9|TMS0719|(+)-3-O-methyl-d-chiro-inositol|HY-N2421|s9343|(1R,2S,4R,5S)-6-Methoxycyclohexane-1,2,3,4,5-pentaol|(1R,2S,4R,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
| Molecular Formula | C7H14O6 |
|---|---|
| Molecular Weight | 194.07904 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.07904 |
| Monoisotopic Mass | 194.07904 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 7600-53-5 |
|---|---|
| SMILES | COC1[C@@H]([C@H](C([C@H]([C@@H]1O)O)O)O)O |
| InChIKey | DSCFFEYYQKSRSV-MVWKSXLKSA-N |
Product Overview
Sequoyitol (CAS 7600-53-5), with molecular formula C7H14O6 and molecular weight 194.07904 g/mol. IUPAC: (1R,2S,4R,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol.
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