(3S)-3-[[(2S,3R)-2-azanyl-3-oxidanyl-butanoyl]amino]-4-[[(2S)-1-[(2S)-2-[(2S)-2-[[(2S)-6-azanyl-1-oxidanylidene-1-[[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]hexan-2-yl]carbamoyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-[[(2S,3R)-2-azanyl-3-oxidanyl-butanoyl]amino]-4-[[(2S)-1-[(2S)-2-[(2S)-2-[[(2S)-6-azanyl-1-oxidanylidene-1-[[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]hexan-2-yl]carbamoyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-4-[[(1S)-2-[(2S)-2-[(2S)-2-[[(1S)-5-amino-1-[[(1S)-2-hydroxy-1-methyl-2-oxo-ethyl]carbamoyl]pentyl]carbamoyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-[[(2S,3R)-2-amino-3-hydroxy-1-oxobutyl]amino]-4-[[(2S)-1-[(2S)-2-[[(2S)-2-[[[(2S)-6-amino-1-[[(2S)-1-hydroxy-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-oxomethyl]-1-pyrrolidinyl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-[[(2S)-1-[(2S)-2-[(2S)-2-[[(2S)-6-amino-1-[[(2S)-1-hydroxy-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]carbamoyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-4-[[(1S)-2-[(2S)-2-[(2S)-2-[[(1S)-5-amino-1-[[(1S)-2-hydroxy-2-keto-1-methyl-ethyl]carbamoyl]pentyl]carbamoyl]pyrrolidine-1-carbonyl]pyrrolidino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-4-keto-butyric acid Formula: C33H52N10O11 MolecularWeight: 764.82638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(CC(=O)O)C(=O)NC(CC1=CN=CN1)C(=O)N2CCCC2C(=O)N3CCCC3C(=O)NC(CCCCN)C(=O)NC(C)C(=O)O)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)N)O

InChI

InChI=1S/C33H52N10O11/c1-17(33(53)54)38-27(47)20(7-3-4-10-34)39-29(49)23-8-5-11-42(23)32(52)24-9-6-12-43(24)31(51)22(13-19-15-36-16-37-19)41-28(48)21(14-25(45)46)40-30(50)26(35)18(2)44/h15-18,20-24,26,44H,3-14,34-35H2,1-2H3,(H,36,37)(H,38,47)(H,39,49)(H,40,50)(H,41,48)(H,45,46)(H,53,54)/t17-,18+,20-,21-,22-,23-,24-,26-/m0/s1