Succinyl-phe-glu-pro-ile-pro-glu-glu-tyr-cyclohexylalanine-gln
[CAS# 138828-04-3]

Identification

• Name: Succinyl-phe-glu-pro-ile-pro-glu-glu-tyr-cyclohexylalanine-gln
• Synonyms: (4S)-5-[(2S)-2-[[(1S,2S)-1-[(2S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-2-[[(1S)-4-Amino-1-Carboxy-4-Oxo-Butyl]-[(2S)-2-Amino-3-Cyclohexyl-Propanoyl]Amino]-1-[(4-Hydroxyphenyl)Methyl]-2-Oxo-Ethyl]Carbamoyl]-4-Hydroxy-4-Oxo-Butyl]Carbamoyl]-4-Hydroxy-4-Oxo-Butyl]Carbamoyl]Pyrrolidine-1-Carbonyl]-2-Methyl-Butyl]Carbamoyl]Pyrrolidin-1-Yl]-4-[[(2S)-2-[(4-Hydroxy-4-Oxo-Butanoyl)Amino]-3-Phenyl-Propanoyl]Amino]-5-Oxo-Pentanoic Acid; (4S)-5-[(2S)-2-[[[(1S,2S)-1-[[(2S)-2-[[[(1S)-1-[[[(1S)-1-[[[(1S)-2-[[(1S)-4-Amino-1-Carboxy-4-Oxobutyl]-[(2S)-2-Amino-3-Cyclohexyl-1-Oxopropyl]Amino]-1-[(4-Hydroxyphenyl)Methyl]-2-Oxoethyl]Amino]-Oxomethyl]-4-Hydroxy-4-Oxobutyl]Amino]-Oxomethyl]-4-Hydroxy-4-Oxobutyl]Amino]-Oxomethyl]-1-Pyrrolidinyl]-Oxomethyl]-2-Methylbutyl]Amino]-Oxomethyl]-1-Pyrrolidinyl]-4-[[(2S)-2-[(4-Hydroxy-1,4-Dioxobutyl)Amino]-1-Oxo-3-Phenylpropyl]Amino]-5-Oxopentanoic Acid; (4S)-5-[(2S)-2-[[(1S,2S)-1-[(2S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-2-[[(1S)-4-Amino-1-Carboxy-4-Keto-Butyl]-[(2S)-2-Amino-3-Cyclohexyl-Propanoyl]Amino]-1-(4-Hydroxybenzyl)-2-Keto-Ethyl]Carbamoyl]-4-Hydroxy-4-Keto-Butyl]Carbamoyl]-4-Hydroxy-4-Keto-Butyl]Carbamoyl]Pyrrolidine-1-Carbonyl]-2-Methyl-Butyl]Carbamoyl]Pyrrolidin-1-Yl]-4-[[(2S)-2-[(4-Hydroxy-4-Keto-Butanoyl)Amino]-3-Phenyl-Propanoyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₆₇H₉₃N₁₁O₂₂
• Molecular Weight: 1404.53
• CAS Registry Number: 138828-04-3
• SMILES: [C@@H]3(N(C(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCC(=O)O)CC1=CC=CC=C1)CCC(=O)O)CCC2)[C@H](CC)C)CCC3)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O)CCC(=O)N)C(=O)[C@@H](N)CC4CCCCC4)CC5=CC=C(O)C=C5)CCC(=O)O)CCC(=O)O
• InChI: 1S/C67H93N11O22/c1-3-37(2)57(75-62(94)49-17-10-32-76(49)64(96)45(24-30-55(86)87)73-60(92)46(35-39-14-8-5-9-15-39)70-52(81)27-31-56(88)89)66(98)77-33-11-16-48(77)61(93)72-44(23-29-54(84)85)58(90)71-43(22-28-53(82)83)59(91)74-47(36-40-18-20-41(79)21-19-40)65(97)78(50(67(99)100)25-26-51(69)80)63(95)42(68)34-38-12-6-4-7-13-38/h5,8-9,14-15,18-21,37-38,42-50,57,79H,3-4,6-7,10-13,16-17,22-36,68H2,1-2H3,(H2,69,80)(H,70,81)(H,71,90)(H,72,93)(H,73,92)(H,74,91)(H,75,94)(H,82,83)(H,84,85)(H,86,87)(H,88,89)(H,99,100)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,57-/m0/s1
• InChIKey: BYWFWGVNLIBMIK-VMIARKKQSA-N