methyl (2S)-2-[[(2S)-4-methyl-2-[methyl-[(2S)-3-methyl-2-[[(2S)-4-methyl-2-[methyl-[2-[methyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]ethanoyl]amino]pentanoyl]amino]butanoyl]amino]pentanoyl]amino]propanoate

Systemtic Name: methyl (2S)-2-[[(2S)-4-methyl-2-[methyl-[(2S)-3-methyl-2-[[(2S)-4-methyl-2-[methyl-[2-[methyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]ethanoyl]amino]pentanoyl]amino]butanoyl]amino]pentanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-(tert-butoxycarbonylamino)butanoyl]-methyl-amino]acetyl]-methyl-amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-4-methyl-pentanoyl]amino]propanoate CAS Name: (2S)-2-[[(2S)-4-methyl-2-[methyl-[(2S)-3-methyl-2-[[(2S)-4-methyl-2-[methyl-[2-[methyl-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]-1-oxoethyl]amino]-1-oxopentyl]amino]-1-oxobutyl]amino]-1-oxopentyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-4-methyl-2-[methyl-[(2S)-3-methyl-2-[[(2S)-4-methyl-2-[methyl-[2-[methyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]acetyl]amino]pentanoyl]amino]butanoyl]amino]pentanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-(tert-butoxycarbonylamino)butanoyl]-methyl-amino]acetyl]-methyl-amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-4-methyl-pentanoyl]amino]propionic acid methyl ester Formula: C35H64N6O9 MolecularWeight: 712.91746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C)CC(=O)N(C)C(CC(C)C)C(=O)NC(C(C)C)C(=O)N(C)C(CC(C)C)C(=O)NC(C)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@@H](C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C35H64N6O9/c1-16-24(37-34(48)50-35(9,10)11)31(45)39(12)19-27(42)40(13)25(17-20(2)3)30(44)38-28(22(6)7)32(46)41(14)26(18-21(4)5)29(43)36-23(8)33(47)49-15/h20-26,28H,16-19H2,1-15H3,(H,36,43)(H,37,48)(H,38,44)/t23-,24-,25-,26-,28-/m0/s1