(2R)-2-acetamido-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[(2S,4R)-2-[[(2S)-1-azanyl-1-oxidanylidene-pentan-2-yl]carbamoyl]-4-phenylmethoxy-pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1,3-bis(oxidanylidene)propan-2-yl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: (2R)-2-acetamido-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[(2S,4R)-2-[[(2S)-1-azanyl-1-oxidanylidene-pentan-2-yl]carbamoyl]-4-phenylmethoxy-pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1,3-bis(oxidanylidene)propan-2-yl]amino]-3-oxidanylidene-propanoic acid Openeye Name: (2R)-2-acetamido-3-[[(1S)-1-[[(1S,2S)-1-[[(1S)-1-[(2S,4R)-4-benzyloxy-2-[[(1S)-1-carbamoylbutyl]carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-hydroxy-2-oxo-ethyl]amino]-3-oxo-propanoic acid CAS Name: (2R)-2-acetamido-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[(2S,4R)-2-[[[(2S)-1-amino-1-oxopentan-2-yl]amino]-oxomethyl]-4-phenylmethoxy-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1,3-dioxopropan-2-yl]amino]-3-oxopropanoic acid IUPAC Name: (2R)-2-acetamido-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[(2S,4R)-2-[[(2S)-1-amino-1-oxopentan-2-yl]carbamoyl]-4-phenylmethoxypyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1,3-dioxopropan-2-yl]amino]-3-oxopropanoic acid Traditional Name: (2R)-2-acetamido-3-[[(1S)-1-[[(1S,2S)-1-[[(1S)-1-[(2S,4R)-4-benzoxy-2-[[(1S)-1-carbamoylbutyl]carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-hydroxy-2-keto-ethyl]amino]-3-keto-propionic acid Formula: C36H53N7O12 MolecularWeight: 775.84572

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N)NC(=O)C1CC(CN1C(=O)C(C(C)C)NC(=O)C(C(C)CC)NC(=O)C(C(=O)O)NC(=O)C(C(=O)O)NC(=O)C)OCC2=CC=CC=C2

Isomeric SMILES

CCC[C@@H](C(=O)N)NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](C(=O)O)NC(=O)[C@H](C(=O)O)NC(=O)C)OCC2=CC=CC=C2

InChI

InChI=1S/C36H53N7O12/c1-7-12-23(29(37)45)39-30(46)24-15-22(55-17-21-13-10-9-11-14-21)16-43(24)34(50)25(18(3)4)40-31(47)26(19(5)8-2)41-33(49)28(36(53)54)42-32(48)27(35(51)52)38-20(6)44/h9-11,13-14,18-19,22-28H,7-8,12,15-17H2,1-6H3,(H2,37,45)(H,38,44)(H,39,46)(H,40,47)(H,41,49)(H,42,48)(H,51,52)(H,53,54)/t19-,22+,23-,24-,25-,26-,27+,28-/m0/s1