(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]propanoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]propanoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(2S)-2-[[[(2S)-1-[[(2S)-1-[(2S)-3-(1H-indol-3-yl)-1-oxo-2-[[oxo-[(2S)-2-pyrrolidinyl]methyl]amino]propyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-prolyl]amino]propanoyl]prolyl]prolyl]amino]-4-methyl-pentanoyl]amino]-3-methyl-butyric acid Formula: C37H53N7O7 MolecularWeight: 707.85942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(C)C)C(=O)O)NC(=O)C1CCCN1C(=O)C2CCCN2C(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C5CCCN5

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]2CCCN2C(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@@H]5CCCN5

InChI

InChI=1S/C37H53N7O7/c1-21(2)18-27(33(46)42-31(22(3)4)37(50)51)40-34(47)29-13-8-16-43(29)36(49)30-14-9-17-44(30)35(48)28(41-32(45)26-12-7-15-38-26)19-23-20-39-25-11-6-5-10-24(23)25/h5-6,10-11,20-22,26-31,38-39H,7-9,12-19H2,1-4H3,(H,40,47)(H,41,45)(H,42,46)(H,50,51)/t26-,27-,28-,29-,30-,31-/m0/s1