tert-butyl (2S)-2-[[(2R)-1-[(2S)-2-[[(2S,3S)-3-methyl-1-[[(2S,3S)-3-methyl-1-[[(2S)-3-methyl-1-oxidanylidene-1-phenylmethoxy-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(2R)-1-[(2S)-2-[[(2S,3S)-3-methyl-1-[[(2S,3S)-3-methyl-1-[[(2S)-3-methyl-1-oxidanylidene-1-phenylmethoxy-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(1R)-1-benzyl-2-[(2S)-2-[[(1S,2S)-1-[[(1S,2S)-1-[[(1S)-1-benzyloxycarbonyl-2-methyl-propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-methyl-butyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(2R)-1-[(2S)-2-[[[(2S,3S)-3-methyl-1-[[(2S,3S)-3-methyl-1-[[(2S)-3-methyl-1-oxo-1-phenylmethoxybutan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2R)-1-[(2S)-2-[[(2S,3S)-3-methyl-1-[[(2S,3S)-3-methyl-1-[[(2S)-3-methyl-1-oxo-1-phenylmethoxybutan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(1R)-1-benzyl-2-[(2S)-2-[[(1S,2S)-1-[[(1S,2S)-1-[[(1S)-1-carbobenzoxy-2-methyl-propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-methyl-butyl]carbamoyl]pyrrolidino]-2-keto-ethyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C48H70N6O9 MolecularWeight: 875.1042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)CC)C(=O)NC(C(C)C)C(=O)OCC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)C(CC3=CC=CC=C3)NC(=O)C4CCCN4C(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(=O)OCC1=CC=CC=C1)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC3=CC=CC=C3)NC(=O)[C@@H]4CCCN4C(=O)OC(C)(C)C

InChI

InChI=1S/C48H70N6O9/c1-10-31(5)39(44(58)52-40(32(6)11-2)43(57)50-38(30(3)4)46(60)62-29-34-22-16-13-17-23-34)51-42(56)36-24-18-26-53(36)45(59)35(28-33-20-14-12-15-21-33)49-41(55)37-25-19-27-54(37)47(61)63-48(7,8)9/h12-17,20-23,30-32,35-40H,10-11,18-19,24-29H2,1-9H3,(H,49,55)(H,50,57)(H,51,56)(H,52,58)/t31-,32-,35+,36-,37-,38-,39-,40-/m0/s1