citronellyl alpha-D-mannopyranosyl phosphate
3,7-dimethyloct-6-enyl [(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
Also Known As: Citronellyl alpha-D-mannopyranosyl phosphate|alpha-D-Mannopyranose, 1-(3,7-dimethyl-6-octenyl hydrogen phosphate)|3,7-dimethyloct-6-enyl [(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate|1-o-{[(3,7-dimethyloct-6-en-1-yl)oxy](hydroxy)phosphoryl}-|A-d-mannopyranose|1-O-{[(3,7-Dimethyloct-6-en-1-yl)oxy](hydroxy)phosphoryl}hexopyranose|alpha-D-Mannopyranose 1-phosphoric acid 3,7-dimethyl-6-octenyl ester|1-O-{[(3,7-Dimethyloct-6-en-1-yl)oxy](hydroxy)phosphoryl}-alpha-D-mannopyranose|[(3,7-dimethyloct-6-en-1-yl)oxy]({[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphinic acid
| Molecular Formula | C16H31O9P |
|---|---|
| Molecular Weight | 398.17056 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 398.17056 |
| Monoisotopic Mass | 398.17056 |
| Heavy Atoms | 26 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 6337-83-3 |
|---|---|
| SMILES | CC(CCC=C(C)C)CCOP(=O)(O)O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| InChIKey | BKOPRMUTOOJOFZ-YOPVGWMHSA-N |
Product Overview
citronellyl alpha-D-mannopyranosyl phosphate (CAS 6337-83-3), with molecular formula C16H31O9P and molecular weight 398.17056 g/mol. IUPAC: 3,7-dimethyloct-6-enyl [(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate.