Products 2315262-12-3
CAS 2315262-12-3 appears in our catalog under these names: 18:1 PE AF 594 (triammonium), 96.97%, 18:1 PE-topfluor AF594. Offered by: MedChemExpress, Sigma-Aldrich. Available pack sizes: 5 mg, 1 mg, 250UG.
Azane;5-[2-[[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy]-hydroxyphosphoryl]oxyethylcarbamoyl]-2-[6,7,7,19,19,20-hexamethyl-9,17-bis(sulfomethyl)-2-oxa-20-aza-6-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(14),3,5,8,10,12,15,17,21-nonaen-13-yl]benzoate (CAS 2315262-12-3) is a chemical compound with the molecular formula C76H119N6O18PS2 and a molecular weight of 1499.9 g/mol. IUPAC name: azane;5-[2-[[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy]-hydroxyphosphoryl]oxyethylcarbamoyl]-2-[6,7,7,19,19,20-hexamethyl-9,17-bis(sulfomethyl)-2-oxa-20-aza-6-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(14),3,5,8,10,12,15,17,21-nonaen-13-yl]benzoate. InChIKey: HYTGXSOTJAVHFH-UEMIVSHXSA-N.
| Molecular formula | C76H119N6O18PS2 |
|---|---|
| Molecular weight | 1499.9 g/mol |
| IUPAC name | azane;5-[2-[[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy]-hydroxyphosphoryl]oxyethylcarbamoyl]-2-[6,7,7,19,19,20-hexamethyl-9,17-bis(sulfomethyl)-2-oxa-20-aza-6-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(14),3,5,8,10,12,15,17,21-nonaen-13-yl]benzoate |
| InChIKey | HYTGXSOTJAVHFH-UEMIVSHXSA-N |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCNC(=O)C1=CC(=C(C=C1)C2=C3C=C4C(=[N+](C(C=C4CS(=O)(=O)O)(C)C)C)C=C3OC5=C2C=C6C(=C5)N(C(C=C6CS(=O)(=O)O)(C)C)C)C(=O)[O-])OC(=O)CCCCCCC/C=C\CCCCCCCC.N.N.N |
Computed by PubChem (NCBI)