methyl (2R,3R)-2-[2-[[(2S)-1-[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]pyrrolidin-2-yl]carbonylamino]ethanoylamino]-3-oxidanyl-butanoate

Systemtic Name: methyl (2R,3R)-2-[2-[[(2S)-1-[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]pyrrolidin-2-yl]carbonylamino]ethanoylamino]-3-oxidanyl-butanoate Openeye Name: methyl (2R,3R)-2-[[2-[[(2S)-1-[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-hydroxy-butanoate CAS Name: (2R,3R)-3-hydroxy-2-[[2-[[[(2S)-1-[(2S)-4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R,3R)-3-hydroxy-2-[[2-[[(2S)-1-[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]butanoate Traditional Name: (2R,3R)-2-[[2-[[(2S)-1-[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]prolyl]amino]acetyl]amino]-3-hydroxy-butyric acid methyl ester Formula: C26H38N4O8 MolecularWeight: 534.60192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCC1C(=O)NCC(=O)NC(C(C)O)C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H]([C@H](C(=O)OC)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C26H38N4O8/c1-16(2)13-19(28-26(36)38-15-18-9-6-5-7-10-18)24(34)30-12-8-11-20(30)23(33)27-14-21(32)29-22(17(3)31)25(35)37-4/h5-7,9-10,16-17,19-20,22,31H,8,11-15H2,1-4H3,(H,27,33)(H,28,36)(H,29,32)/t17-,19+,20+,22-/m1/s1