H 189
[CAS# 90145-64-5]

Identification

• Name: H 189
• Synonyms: (2S)-6-Amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(3S,4S)-3-Hydroxy-4-[[(2S)-3-(3H-Imidazol-4-Yl)-2-[[(2S)-2-[[(2S)-1-[(2S)-3-(3H-Imidazol-4-Yl)-2-[[(2S)-Pyrrolidine-2-Carbonyl]Amino]Propanoyl]Pyrrolidine-2-Carbonyl]Amino]-3-Phenyl-Propanoyl]Amino]Propanoyl]
• Molecular Formula: C₆₂H₉₃N₁₇O₁₂
• Molecular Weight: 1268.52
• CAS Registry Number: 90145-64-5
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)[C@H]2NCCC2)CC3=CN=C[NH]3)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@H](CC)C)C(=O)N[C@@H](CC5=CN=C[NH]5)C(=O)N[C@@H](CCCCN)C(O)=O)CC6=CN=C[NH]6
• InChI: 1S/C62H93N17O12/c1-7-37(6)53(60(88)75-47(26-40-30-65-33-69-40)56(84)71-43(62(90)91)17-11-12-20-63)78-59(87)52(36(4)5)77-51(81)28-50(80)44(23-35(2)3)72-57(85)46(25-39-29-64-32-68-39)73-55(83)45(24-38-15-9-8-10-16-38)74-58(86)49-19-14-22-79(49)61(89)48(27-4
• InChIKey: PZJOKAFPZVCZBJ-DJQQXEBLSA-N

Properties

• Density: 1.287g/cm³ (Cal.)
• Boiling point: 1679.044°C at 760 mmHg (Cal.)
• Flash point: 969.251°C (Cal.)