(2S)-5-azanyl-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-6-azanyl-2-[[(2S)-2-(2-azanylethanoylamino)propanoyl]amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-5-azanyl-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-6-azanyl-2-[[(2S)-2-(2-azanylethanoylamino)propanoyl]amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]propanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-5-amino-2-[[[(2S)-1-[(2S)-2-[[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[(2-amino-1-oxoethyl)amino]-1-oxopropyl]amino]-1-oxohexyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]propanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoic acid Traditional Name: (2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-(glycylamino)propanoyl]amino]hexanoyl]prolyl]amino]-3-(1H-imidazol-5-yl)propanoyl]prolyl]amino]-5-keto-valeric acid Formula: C32H51N11O9 MolecularWeight: 733.81564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NC(CC2=CN=CN2)C(=O)N3CCCC3C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)CN

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CN=CN2)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)CN

InChI

InChI=1S/C32H51N11O9/c1-18(38-26(45)15-34)27(46)39-20(6-2-3-11-33)30(49)42-12-4-8-24(42)29(48)41-22(14-19-16-36-17-37-19)31(50)43-13-5-7-23(43)28(47)40-21(32(51)52)9-10-25(35)44/h16-18,20-24H,2-15,33-34H2,1H3,(H2,35,44)(H,36,37)(H,38,45)(H,39,46)(H,40,47)(H,41,48)(H,51,52)/t18-,20-,21-,22-,23-,24-/m0/s1