(2S)-2-(4-Aminobutanoylamino)-4-[(2R)-2-Amino-3-Hydroxy-3-Oxopropyl]Sulfanylbutanoic Acid
[CAS# 77659-42-8]

Identification

• Name: (2S)-2-(4-Aminobutanoylamino)-4-[(2R)-2-Amino-3-Hydroxy-3-Oxopropyl]Sulfanylbutanoic Acid
• Synonyms: (2S)-2-(4-Aminobutanoylamino)-4-[(2R)-2-Amino-3-Hydroxy-3-Oxo-Propyl]Sulfanyl-Butanoic Acid; (2S)-4-[[(2R)-2-Amino-3-Hydroxy-3-Oxopropyl]Thio]-2-[(4-Amino-1-Oxobutyl)Amino]Butanoic Acid; (2S)-2-(4-Aminobutanoylamino)-4-[[(2R)-2-Amino-3-Hydroxy-3-Keto-Propyl]Thio]Butyric Acid
• Molecular Formula: C₁₁H₂₁N₃O₅S
• Molecular Weight: 307.36
• CAS Registry Number: 77659-42-8
• SMILES: [C@H](C(=O)O)(NC(CCCN)=O)CCSC[C@@H](C(=O)O)N
• InChI: 1S/C11H21N3O5S/c12-4-1-2-9(15)14-8(11(18)19)3-5-20-6-7(13)10(16)17/h7-8H,1-6,12-13H2,(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1
• InChIKey: HLZQGCPYTRRAMG-YUMQZZPRSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 656.747°C at 760 mmHg (Cal.)
• Flash point: 350.988°C (Cal.)