Senktide
[CAS# 106128-89-6]

Identification

• Name: Senktide
• Synonyms: (3S)-4-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[(1S)-1-Carbamoyl-3-Methylsulfanyl-Propyl]Carbamoyl]-3-Methyl-Butyl]Amino]-2-Oxo-Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]-Methyl-Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-3-[(4-Hydroxy-4-Oxo-Butanoyl)Amino]-4-Oxo-Butanoic Acid; (3S)-4-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[[(1S)-1-Carbamoyl-3-(Methylthio)Propyl]Amino]-Oxomethyl]-3-Methylbutyl]Amino]-2-Oxoethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]-Methylamino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-3-[(4-Hydroxy-1,4-Dioxobutyl)Amino]-4-Oxobutanoic Acid; (3S)-4-[[(1S)-1-(Benzyl)-2-[[(1S)-1-(Benzyl)-2-[[2-[[(1S)-1-[[(1S)-1-Carbamoyl-3-(Methylthio)Propyl]Carbamoyl]-3-Methyl-Butyl]Amino]-2-Keto-Ethyl]Amino]-2-Keto-Ethyl]-Methyl-Amino]-2-Keto-Ethyl]Amino]-3-[(4-Hydroxy-4-Keto-Butanoyl)Amino]-4-Keto-Butyric Acid
• Molecular Formula: C₄₀H₅₅N₇O₁₁S
• Molecular Weight: 841.97
• CAS Registry Number: 106128-89-6
• SMILES: [C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCC(=O)O)CC(=O)O)CC1=CC=CC=C1)C)(C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CC(C)C)CC2=CC=CC=C2
• InChI: 1S/C40H55N7O11S/c1-24(2)19-28(37(55)45-27(36(41)54)17-18-59-4)44-33(49)23-42-39(57)31(21-26-13-9-6-10-14-26)47(3)40(58)30(20-25-11-7-5-8-12-25)46-38(56)29(22-35(52)53)43-32(48)15-16-34(50)51/h5-14,24,27-31H,15-23H2,1-4H3,(H2,41,54)(H,42,57)(H,43,48)(H,44,49)(H,45,55)(H,46,56)(H,50,51)(H,52,53)/t27-,28-,29-,30-,31-/m0/s1
• InChIKey: HMHYXLVEFVGOPM-QKUYTOGTSA-N

Properties

• Density: 1.29g/cm³ (Cal.)
• Boiling point: 1262.638°C at 760 mmHg (Cal.)
• Flash point: 717.418°C (Cal.)