[(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-oxidanylidene-1-[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]oxy-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]oxy-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]oxy-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] (2S)-4-methyl-2-(methylamino)pentanoate

Systemtic Name: [(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-oxidanylidene-1-[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]oxy-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]oxy-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]oxy-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] (2S)-4-methyl-2-(methylamino)pentanoate Openeye Name: [(1R)-1-benzyl-2-[[(1S)-1-[(1R)-2-[[(1S)-1-[(1R)-1-benzyl-2-[[(1S)-1-[(1R)-2-benzyloxy-1-methyl-2-oxo-ethoxy]carbonyl-3-methyl-butyl]-methyl-amino]-2-oxo-ethoxy]carbonyl-3-methyl-butyl]-methyl-amino]-1-methyl-2-oxo-ethoxy]carbonyl-3-methyl-butyl]-methyl-amino]-2-oxo-ethyl] (2S)-4-methyl-2-(methylamino)pentanoate CAS Name: (2S)-4-methyl-2-(methylamino)pentanoic acid [(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-oxo-1-[(2R)-1-oxo-1-phenylmethoxypropan-2-yl]oxypentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]oxy-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]oxy-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-[(2R)-1-[methyl-[(2S)-4-methyl-1-oxo-1-[(2R)-1-oxo-1-phenylmethoxypropan-2-yl]oxypentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]oxy-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]oxy-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] (2S)-4-methyl-2-(methylamino)pentanoate Traditional Name: (2S)-4-methyl-2-(methylamino)valeric acid [(1R)-2-[[(1S)-1-[(1R)-2-[[(1S)-1-[(1R)-2-[[(1S)-1-[(1R)-2-benzoxy-2-keto-1-methyl-ethoxy]carbonyl-3-methyl-butyl]-methyl-amino]-1-benzyl-2-keto-ethoxy]carbonyl-3-methyl-butyl]-methyl-amino]-2-keto-1-methyl-ethoxy]carbonyl-3-methyl-butyl]-methyl-amino]-1-benzyl-2-keto-ethyl] ester Formula: C59H84N4O13 MolecularWeight: 1057.31726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(CC1=CC=CC=C1)C(=O)N(C)C(CC(C)C)C(=O)OC(C)C(=O)N(C)C(CC(C)C)C(=O)OC(CC2=CC=CC=C2)C(=O)N(C)C(CC(C)C)C(=O)OC(C)C(=O)OCC3=CC=CC=C3)NC

Isomeric SMILES

C[C@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](CC1=CC=CC=C1)C(=O)N(C)[C@@H](CC(C)C)C(=O)O[C@H](C)C(=O)OCC2=CC=CC=C2)OC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC3=CC=CC=C3)OC(=O)[C@H](CC(C)C)NC

InChI

InChI=1S/C59H84N4O13/c1-37(2)30-46(60-11)56(68)75-50(34-43-24-18-15-19-25-43)53(65)62(13)47(31-38(3)4)57(69)73-41(9)52(64)61(12)49(33-40(7)8)59(71)76-51(35-44-26-20-16-21-27-44)54(66)63(14)48(32-39(5)6)58(70)74-42(10)55(67)72-36-45-28-22-17-23-29-45/h15-29,37-42,46-51,60H,30-36H2,1-14H3/t41-,42-,46+,47+,48+,49+,50-,51-/m1/s1