Showing Metabocard for 1-hexadecanoyl-2-(9-oxononanoyl)-sn-glycero-3-phosphocholine (BASm0004050)
| Common Name | 1-hexadecanoyl-2-(9-oxononanoyl)-sn-glycero-3-phosphocholine |
|---|---|
| Description | A 1,2-diacyl-sn-glycero-3-phosphocholine in which the 1- and 2-acyl groups are specified as hexadecanoyl and 9-oxononanoyl respectively. |
| Structure | |
| Molecular Formula | C33H64NO9P |
| Average Mass | 649.83800 |
| Monoisotopic Mass | Not Available |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=O |
| InChI Identifier | InChI=1S/C33H64NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-18-21-24-32(36)40-29-31(30-42-44(38,39)41-28-26-34(2,3)4)43-33(37)25-22-19-16-17-20-23-27-35/h27,31H,5-26,28-30H2,1-4H3/t31-/m1/s1 |
| InChI Key | PPTNNIINSOQWCE-WJOKGBTCSA-N |
| CHEBI ID | CHEBI:61042 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | 0 |
| Polarizability | Not Available |