Pyr-His-Trp-Ser-Tyr-Gly-Leu-Gln-Pro-Gly-NH2
[CAS# 47922-48-5]

Identification

• Name: Pyr-His-Trp-Ser-Tyr-Gly-Leu-Gln-Pro-Gly-NH2
• Synonyms: (2S)-N-[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[(1S)-4-Amino-1-[(2S)-2-[(2-Amino-2-Oxo-Ethyl)Carbamoyl]Pyrrolidine-1-Carbonyl]-4-Oxo-Butyl]Carbamoyl]-3-Methyl-Butyl]Amino]-2-Oxo-Ethyl]Amino]-1-[(4-Hydroxyphenyl)Methyl]-2-Oxo-Ethyl]Amino]-1-(Hydroxymethyl)-2-Oxo-Ethyl]Amino]-1-(1H-Indol-3-Ylmethyl)-2-Oxo-Ethyl]Amino]-1-(3H-Imidazol-4-Ylmethyl)-2-Oxo-Ethyl]-5-Oxo-Pyrrolidine-2-Carboxamide; (2S)-N-[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[[(1S)-4-Amino-1-[[(2S)-2-[[(2-Amino-2-Oxoethyl)Amino]-Oxomethyl]-1-Pyrrolidinyl]-Oxomethyl]-4-Oxobutyl]Amino]-Oxomethyl]-3-Methylbutyl]Amino]-2-Oxoethyl]Amino]-1-[(4-Hydroxyphenyl)Methyl]-2-Oxoethyl]Amino]-1-(Hydroxymethyl)-2-Oxoethyl]Amino]-1-(1H-Indol-3-Ylmethyl)-2-Oxoethyl]Amino]-1-(3H-Imidazol-4-Ylmethyl)-2-Oxoethyl]-5-Oxo-2-Pyrrolidinecarboxamide; (2S)-N-[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[(1S)-4-Amino-1-[(2S)-2-[(2-Amino-2-Keto-Ethyl)Carbamoyl]Pyrrolidine-1-Carbonyl]-4-Keto-Butyl]Carbamoyl]-3-Methyl-Butyl]Amino]-2-Keto-Ethyl]Amino]-1-(4-Hydroxybenzyl)-2-Keto-Ethyl]Amino]-2-Keto-1-Methylol-Ethyl]Amino]-1-(1H-Indol-3-Ylmethyl)-2-Keto-Ethyl]Amino]-1-(3H-Imidazol-4-Ylmethyl)-2-Keto-Ethyl]-5-Keto-Pyrrolidine-2-Carboxamide
• Molecular Formula: C₅₄H₇₁N₁₅O₁₄
• Molecular Weight: 1154.25
• CAS Registry Number: 47922-48-5
• SMILES: [C@@H]1(NC(=O)CC1)C(=O)N[C@H](C(=O)N[C@@H](CC2=C[NH]C3=C2C=CC=C3)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N4[C@H](C(=O)NCC(=O)N)CCC4)CCC(=O)N)CC(C)C)CC5=CC=C(O)C=C5)CO)CC6=CN=C[NH]6
• InChI: 1S/C54H71N15O14/c1-28(2)18-37(49(78)64-36(13-15-43(55)72)54(83)69-17-5-8-42(69)53(82)59-24-44(56)73)63-46(75)25-60-47(76)38(19-29-9-11-32(71)12-10-29)65-52(81)41(26-70)68-50(79)39(20-30-22-58-34-7-4-3-6-33(30)34)66-51(80)40(21-31-23-57-27-61-31)67-48(77)35-14-16-45(74)62-35/h3-4,6-7,9-12,22-23,27-28,35-42,58,70-71H,5,8,13-21,24-26H2,1-2H3,(H2,55,72)(H2,56,73)(H,57,61)(H,59,82)(H,60,76)(H,62,74)(H,63,75)(H,64,78)(H,65,81)(H,66,80)(H,67,77)(H,68,79)/t35-,36-,37-,38-,39-,40-,41-,42-/m0/s1
• InChIKey: WPKQYFUSPONRAT-BXXNOCLASA-N

Properties

• Density: 1.398g/cm³ (Cal.)
• Boiling point: 1811.996°C at 760 mmHg (Cal.)
• Flash point: 1049.657°C (Cal.)