2-Amino-5-[[1-(Carboxymethylamino)-3-[2-Hydroxy-1,2-Di(Phenyl)Ethyl]Sulfanyl-1-Oxopropan-2-Yl]Amino]-5-Oxopentanoic Acid
[CAS# 105449-15-8]

Identification

• Name: 2-Amino-5-[[1-(Carboxymethylamino)-3-[2-Hydroxy-1,2-Di(Phenyl)Ethyl]Sulfanyl-1-Oxopropan-2-Yl]Amino]-5-Oxopentanoic Acid
• Synonyms: 2-Amino-5-[[2-(Carboxymethylamino)-1-[[2-Hydroxy-1,2-Di(Phenyl)Ethyl]Sulfanylmethyl]-2-Oxo-Ethyl]Amino]-5-Oxo-Pentanoic Acid; 2-Amino-5-[[2-(Carboxymethylamino)-1-[[[2-Hydroxy-1,2-Di(Phenyl)Ethyl]Thio]Methyl]-2-Oxoethyl]Amino]-5-Oxopentanoic Acid; 2-Amino-5-[[2-(Carboxymethylamino)-1-[[[2-Hydroxy-1,2-Di(Phenyl)Ethyl]Thio]Methyl]-2-Keto-Ethyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₂₄H₂₉N₃O₇S
• Molecular Weight: 503.57
• CAS Registry Number: 105449-15-8
• SMILES: C2=C(C(C(O)C1=CC=CC=C1)SCC(C(=O)NCC(=O)O)NC(=O)CCC(N)C(=O)O)C=CC=C2
• InChI: 1S/C24H29N3O7S/c25-17(24(33)34)11-12-19(28)27-18(23(32)26-13-20(29)30)14-35-22(16-9-5-2-6-10-16)21(31)15-7-3-1-4-8-15/h1-10,17-18,21-22,31H,11-14,25H2,(H,26,32)(H,27,28)(H,29,30)(H,33,34)
• InChIKey: QXNTVHQBETYVHO-UHFFFAOYSA-N

Properties

• Density: 1.374g/cm³ (Cal.)
• Boiling point: 878.824°C at 760 mmHg (Cal.)
• Flash point: 485.295°C (Cal.)