N1'-Methoxycarbonylbiotin Methyl Ester
[CAS# 4795-59-9]

Identification

• Name: N1'-Methoxycarbonylbiotin Methyl Ester
• Synonyms: Methyl (3As,4S,6Ar)-4-(5-Methoxy-5-Oxo-Pentyl)-2-Oxo-3A,4,6,6A-Tetrahydro-3H-Thieno[3,4-D]Imidazole-1-Carboxylate; (3As,4S,6Ar)-4-(5-Methoxy-5-Oxopentyl)-2-Oxo-3A,4,6,6A-Tetrahydro-3H-Thieno[3,4-D]Imidazole-1-Carboxylic Acid Methyl Ester; (3As,4S,6Ar)-2-Keto-4-(5-Keto-5-Methoxy-Pentyl)-3A,4,6,6A-Tetrahydro-3H-Thieno[3,4-D]Imidazole-1-Carboxylic Acid Methyl Ester
• Molecular Formula: C₁₃H₂₀N₂O₅S
• Molecular Weight: 316.37
• CAS Registry Number: 4795-59-9
• SMILES: [C@@H]12N(C(N[C@@H]1[C@@H](SC2)CCCCC(=O)OC)=O)C(=O)OC
• InChI: 1S/C13H20N2O5S/c1-19-10(16)6-4-3-5-9-11-8(7-21-9)15(12(17)14-11)13(18)20-2/h8-9,11H,3-7H2,1-2H3,(H,14,17)/t8-,9-,11-/m0/s1
• InChIKey: BNKOHWLXGAGMAQ-QXEWZRGKSA-N

Properties

• Density: 1.262g/cm³ (Cal.)