(2S)-1-[(2S,3S)-2-[[(2S,3S)-3-Ethoxycarbonyloxirane-2-Carbonyl]Amino]-3-Methylpentanoyl]Pyrrolidine-2-Carboxylic Acid
[CAS# 134447-97-5]

Identification

• Name: (2S)-1-[(2S,3S)-2-[[(2S,3S)-3-Ethoxycarbonyloxirane-2-Carbonyl]Amino]-3-Methylpentanoyl]Pyrrolidine-2-Carboxylic Acid
• Synonyms: (2S)-1-[(2S,3S)-2-[[(2S,3S)-3-Ethoxycarbonyloxirane-2-Carbonyl]Amino]-3-Methyl-Pentanoyl]Pyrrolidine-2-Carboxylic Acid; (2S)-1-[(2S,3S)-2-[[[(2S,3S)-3-Ethoxycarbonyl-2-Oxiranyl]-Oxomethyl]Amino]-3-Methyl-1-Oxopentyl]-2-Pyrrolidinecarboxylic Acid; (2S)-1-[(2S,3S)-2-[[(2S,3S)-3-Carbethoxyoxirane-2-Carbonyl]Amino]-3-Methyl-Pentanoyl]Proline
• Molecular Formula: C₁₇H₂₆N₂O₇
• Molecular Weight: 370.40
• CAS Registry Number: 134447-97-5
• SMILES: [C@H]1([C@@H](C(OCC)=O)O1)C(N[C@H](C(N2[C@@H](CCC2)C(O)=O)=O)[C@H](CC)C)=O
• InChI: 1S/C17H26N2O7/c1-4-9(3)11(15(21)19-8-6-7-10(19)16(22)23)18-14(20)12-13(26-12)17(24)25-5-2/h9-13H,4-8H2,1-3H3,(H,18,20)(H,22,23)/t9-,10-,11-,12-,13-/m0/s1
• InChIKey: RFNNDNGXWCBNGK-VLJOUNFMSA-N

Properties

• Density: 1.307g/cm³ (Cal.)
• Boiling point: 620.365°C at 760 mmHg (Cal.)
• Flash point: 328.985°C (Cal.)