Diaporthin
8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxyisochromen-1-one
Also Known As: Diaporthin|(+)-Diaporthin|HY-N14160|(S)-8-Hydroxy-3-(2-hydroxypropyl)-6-methoxy-1H-2-benzopyran-1-one|8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxyisochromen-1-one|Isocoumarin, 8-hydroxy-3-(2-hydroxypropyl)-6-methoxy-, (+)-|1H-2-Benzopyran-1-one, 8-hydroxy-3-(2-hydroxypropyl)-6-methoxy-, (S)-|3-[(S)-2-Hydroxypropyl]-6-methoxy-8-hydroxyisocoumarin|8-hydroxy-3-((2S)-2-hydroxypropyl)-6-methoxyisochromen-1-one|8-Hydroxy-3-(2-hydroxypropyl)-6-methoxy-1H-2-benzopyran-1-one|8-HYDROXY-3-(2-HYDROXYPROPYL)-6-METHOXYISOCHROMEN-1-ONE|8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxy-1H-isochromen-1-one|Isocoumarin,8-hydroxy-3-(2-hydroxypropyl)-6-methoxy-,(+)-(8CI)|8-HYDROXY-3-(2-HYDROXY-PROPYL)-6-METHOXY-ISOCHROMEN-1-ONE, (+)-|8-HYDROXY-3-(2-HYDROXY-PROPYL)-6-METHOXY-ISOCHROMEN-1-ONE, (S)-|8-Hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxy-1H-2-benzopyran-1-one|NCGC00384779-01!8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxyisochromen-1-one
| Molecular Formula | C13H14O5 |
|---|---|
| Molecular Weight | 250.08412 g/mol |
| LogP | 1.4305 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.08412 |
| Monoisotopic Mass | 250.08412 |
| Heavy Atoms | 18 |
| Complexity | 627.04956 |
Chemical Identifiers
| CAS Number | 6512-79-4 |
|---|---|
| SMILES | C[C@@H](CC1=CC2=CC(=CC(=C2C(=O)O1)O)OC)O |
Product Overview
Diaporthin (CAS 6512-79-4), with molecular formula C13H14O5 and molecular weight 250.08412 g/mol. IUPAC: 8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxyisochromen-1-one.