5-Hydroxy-3-(1-hydroxy-3-methylbut-2-en-1-yl)-7-oxabicyclo(4.1.0)hept-3-en-2-one
(1S,5R,6S)-5-hydroxy-3-(1-hydroxy-3-methylbut-2-enyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one
Also Known As: Panepoxydone|Antibiotic SL-3042|KST-1A5908|KST-1A5909|SL-3042|(1s,5r,6s)-5-hydroxy-3-(1-hydroxy-3-methylbut-2-en-1-yl)-7-oxabicyclo[4.1.0]hept-3-en-2-one|5-18-03-00016 (Beilstein Handbook Reference)|(1S,5R,6S)-5-hydroxy-3-(1-hydroxy-3-methylbut-2-enyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one|5-hydroxy-3-(1-hydroxy-3-methyl-2-butenyl)-7-oxabicylo(4.1.0)hept-3-en-2-one|7-Oxabicyclo(4.1.0)hept-3-en-2-one, 5-hydroxy-3-(1-hydroxy-3-methyl-2-butenyl)-, (1S-(1-alpha,3(S*),5-alpha,6-alpha))-|5-Hydroxy-3-(1-hydroxy-3-methylbut-2-en-1-yl)-7-oxabicyclo(4.1.0)hept-3-en-2-one|5-Hydroxy-3-(1-hydroxy-3-methylbut-2-en-1-yl)-7-oxabicyclo[4.1.0]hept-3-en-2-one|(1S,2R,6S)-2-hydroxy-4-(1-hydroxy-3-methylbut-2-enyl)-7-oxabicyclo[4.1.0]hept-3-en-5-one
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.0892 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.0892 |
| Monoisotopic Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 5463-35-4 |
|---|---|
| SMILES | CC(=CC(C1=C[C@H]([C@H]2[C@@H](C1=O)O2)O)O)C |
| InChIKey | MBXKEYXHJAZKBP-VQZXEUHYSA-N |
Product Overview
5-Hydroxy-3-(1-hydroxy-3-methylbut-2-en-1-yl)-7-oxabicyclo(4.1.0)hept-3-en-2-one (CAS 5463-35-4), with molecular formula C11H14O4 and molecular weight 210.0892 g/mol. IUPAC: (1S,5R,6S)-5-hydroxy-3-(1-hydroxy-3-methylbut-2-enyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one.