2-Amino-3-[2-[2-Amino-3-(2-Carboxyethyl)-6,7-Dioxo-1H-Indol-4-Yl]-1H-Indol-3-Yl]Propanoic Acid
[CAS# 134645-25-3]

Identification

• Name: 2-Amino-3-[2-[2-Amino-3-(2-Carboxyethyl)-6,7-Dioxo-1H-Indol-4-Yl]-1H-Indol-3-Yl]Propanoic Acid
• Synonyms: 2-Amino-3-[2-[2-Amino-3-(2-Carboxyethyl)-6,7-Diketo-1H-Indol-4-Yl]-1H-Indol-3-Yl]Propionic Acid; (2,4'-Bi-1H-Indole)-3,3'-Dipropanoic Acid, Alpha,Alpha'-Diamino-6',7'-Dihydro-6',7'-Dioxo-; 4-(2'-Tryptophyl)Tryptophan-6,7-Dione
• Molecular Formula: C₂₂H₂₀N₄O₆
• Molecular Weight: 436.42
• CAS Registry Number: 134645-25-3
• SMILES: C1=CC=CC2=C1C(=C([NH]2)C3=CC(=O)C(=O)C4=C3C(=C([NH]4)N)CCC(=O)O)CC(N)C(=O)O
• InChI: 1S/C22H20N4O6/c23-13(22(31)32)7-11-9-3-1-2-4-14(9)25-18(11)12-8-15(27)20(30)19-17(12)10(21(24)26-19)5-6-16(28)29/h1-4,8,13,25-26H,5-7,23-24H2,(H,28,29)(H,31,32)
• InChIKey: XUQUDEQWGUKCGE-UHFFFAOYSA-N

Properties

• Density: 1.618g/cm³ (Cal.)
• Boiling point: 886.299°C at 760 mmHg (Cal.)
• Flash point: 489.816°C (Cal.)