(2S)-2-[[(2R)-2-[[(2R)-2-Amino-3-Hydroxy-3-Oxopropyl]Amino]-3-Hydroxy-3-Oxopropyl]Amino]Butanedioic Acid
[CAS# 3484-65-9]

Identification

• Name: (2S)-2-[[(2R)-2-[[(2R)-2-Amino-3-Hydroxy-3-Oxopropyl]Amino]-3-Hydroxy-3-Oxopropyl]Amino]Butanedioic Acid
• Synonyms: (2S)-2-[[(2R)-2-[[(2R)-2-Amino-3-Hydroxy-3-Oxo-Propyl]Amino]-3-Hydroxy-3-Oxo-Propyl]Amino]Butanedioic Acid; (2S)-2-[[(2R)-2-[[(2R)-2-Amino-3-Hydroxy-3-Keto-Propyl]Amino]-3-Hydroxy-3-Keto-Propyl]Amino]Succinic Acid; Toxin C (Pyrenophora Teres)
• Molecular Formula: C₁₀H₁₇N₃O₈
• Molecular Weight: 307.26
• CAS Registry Number: 3484-65-9
• SMILES: [C@@H](CN[C@H](C(=O)O)CC(=O)O)(C(=O)O)NC[C@H](C(=O)O)N
• InChI: 1S/C10H17N3O8/c11-4(8(16)17)2-12-6(10(20)21)3-13-5(9(18)19)1-7(14)15/h4-6,12-13H,1-3,11H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)/t4-,5+,6-/m1/s1
• InChIKey: XFTWUNOVBCHBJR-NGJCXOISSA-N

Properties

• Density: 1.579g/cm³ (Cal.)
• Boiling point: 637.597°C at 760 mmHg (Cal.)
• Flash point: 339.406°C (Cal.)