N-[(1S,2R,3E)-2-hydroxy-1-[(phosphonooxy)methyl]-3-heptadecen-1-yl]-hexadecanamide,monoammoniumsalt
CAS: 1246303-22-9
| 1 | N-[(1S,2R,3E)-2-hydroxy-1-[(phosphonooxy)methyl]-3-heptadecen-1-yl]-hexadecanamide,monoammoniumsalt |
| 2 | azanium;[(E,2S,3R)-2-(hexadecanoylamino)-3-hydroxyoctadec-4-enyl] hydrogen phosphate |
| 3 | BP-42419 |
| 4 | PD061150 |
| 5 | HY-145467 |
No description available for this item
| Molecular Formula | C34H71N2O6P |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 634.9000 |
| InChIKey | RCRVTEZMCBPWGN-YWBCJBABSA-N |
| InChI | InChI=1S/C34H68NO6P.H3N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(36)32(31-41-42(38,39)40)35-34(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h27,29,32-33,36H,3-26,28,30-31H2,1-2H3,(H,35,37)(H2,38,39,40);1H3/b29-27+;/t32-,33+;/m0./s1 |
| XLogP | 0.0000 |
| ExactMass | 634.5050 |
| MonoisotopicMass | 634.5050 |
| TPSA | 120.0000 |
| Complexity | 666.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 4 |
| HBondAcceptorCount | 6 |
| RotatableBondCount | 32 |
| HeavyAtomCount | 43 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 2 |
| DefinedAtomStereoCount | 2 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 1 |
| DefinedBondStereoCount | 1 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 2 |
| PatentCount | 0 |
| PatentFamilyCount | 0 |
| LiteratureCount | 0 |