5-[[(2S)-2-[(2R)-2-Carboxy-2-Hydroxy-5-Oxopyrrolidin-1-Yl]Propanoyl]Amino]-2-Hydroxypentane-1,2,3-Tricarboxylic Acid
[CAS# 157568-17-7]

Identification

• Name: 5-[[(2S)-2-[(2R)-2-Carboxy-2-Hydroxy-5-Oxopyrrolidin-1-Yl]Propanoyl]Amino]-2-Hydroxypentane-1,2,3-Tricarboxylic Acid
• Synonyms: 5-[[(2S)-2-[(2R)-2-Carboxy-2-Hydroxy-5-Oxo-Pyrrolidin-1-Yl]Propanoyl]Amino]-2-Hydroxy-Pentane-1,2,3-Tricarboxylic Acid; 5-[[(2S)-2-[(2R)-2-Carboxy-2-Hydroxy-5-Oxo-1-Pyrrolidinyl]-1-Oxopropyl]Amino]-2-Hydroxypentane-1,2,3-Tricarboxylic Acid; 5-[[(2S)-2-[(2R)-2-Carboxy-2-Hydroxy-5-Keto-Pyrrolidin-1-Yl]Propanoyl]Amino]-2-Hydroxy-Pentane-1,2,3-Tricarboxylic Acid
• Molecular Formula: C₁₆H₂₂N₂O₁₂
• Molecular Weight: 434.36
• CAS Registry Number: 157568-17-7
• SMILES: [C@@H](C(NCCC(C(CC(=O)O)(C(=O)O)O)C(=O)O)=O)(C)N1[C@](CCC1=O)(O)C(=O)O
• InChI: 1S/C16H22N2O12/c1-7(18-9(19)2-4-16(18,30)14(27)28)11(22)17-5-3-8(12(23)24)15(29,13(25)26)6-10(20)21/h7-8,29-30H,2-6H2,1H3,(H,17,22)(H,20,21)(H,23,24)(H,25,26)(H,27,28)/t7-,8?,15?,16+/m0/s1
• InChIKey: FPHRKFJYHKRDFJ-LWYCVJHGSA-N

Properties

• Density: 1.698g/cm³ (Cal.)
• Boiling point: 797.984°C at 760 mmHg (Cal.)
• Flash point: 436.405°C (Cal.)