Bis(1-Methylethyl)-Phosphoramidous Acid 1-[[Bis(4-Methoxyphenyl)Phenylmethoxy]Methyl]-21-[(3aS,4S,6aR)-Hexahydro-2-Oxo-1H-Thieno[3,4-d]Imidazol-4-Yl]-17-Oxo-3,6,9,12-Tetraoxa-16-Azaheneicos-1-Yl 2-Cyanoethyl Ester
[CAS# 198080-44-3]

Identification

• Name: Bis(1-Methylethyl)-Phosphoramidous Acid 1-[[Bis(4-Methoxyphenyl)Phenylmethoxy]Methyl]-21-[(3aS,4S,6aR)-Hexahydro-2-Oxo-1H-Thieno[3,4-d]Imidazol-4-Yl]-17-Oxo-3,6,9,12-Tetraoxa-16-Azaheneicos-1-Yl 2-Cyanoethyl Ester
• Synonyms: BIOTIN-TEG CEP
• Molecular Formula: C₅₂H₇₆N₅O₁₁PS
• Molecular Weight: 1010.23
• CAS Registry Number: 198080-44-3
• SMILES: N#CCCOP(N(C(C)C)C(C)C)OC(COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1)COCCOCCOCCOCCCNC(=O)CCCC[C@@H]1SC[C@@H]2[C@H]1NC(=O)N2
• InChI: 1S/C52H76N5O11PS/c1-39(2)57(40(3)4)69(67-29-12-26-53)68-46(37-66-52(41-14-8-7-9-15-41,42-18-22-44(60-5)23-19-42)43-20-24-45(61-6)25-21-43)36-65-35-34-64-33-32-63-31-30-62-28-13-27-54-49(58)17-11