tert-butyl (2S)-4-azanyl-2-[[(2S)-3-[3-[(3S)-3-[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanyl-3-tri(propan-2-yl)silyloxy-propyl]-3-oxidanyl-2-oxidanylidene-1H-indol-7-yl]-4-phenylmethoxy-phenyl]-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl (2S)-4-azanyl-2-[[(2S)-3-[3-[(3S)-3-[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanyl-3-tri(propan-2-yl)silyloxy-propyl]-3-oxidanyl-2-oxidanylidene-1H-indol-7-yl]-4-phenylmethoxy-phenyl]-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxidanylidene-butanoate Openeye Name: tert-butyl (2S)-4-amino-2-[[(2S)-3-[4-benzyloxy-3-[(3S)-3-[(1R,2R)-2-(tert-butoxycarbonylamino)-1-hydroxy-3-triisopropylsilyloxy-propyl]-3-hydroxy-2-oxo-indolin-7-yl]phenyl]-2-(benzyloxycarbonylamino)propanoyl]amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(2S)-3-[3-[(3S)-3-hydroxy-3-[(1R,2R)-1-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-tri(propan-2-yl)silyloxypropyl]-2-oxo-1H-indol-7-yl]-4-phenylmethoxyphenyl]-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-amino-2-[[(2S)-3-[3-[(3S)-3-hydroxy-3-[(1R,2R)-1-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tri(propan-2-yl)silyloxypropyl]-2-oxo-1H-indol-7-yl]-4-phenylmethoxyphenyl]-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[[(2S)-3-[4-benzoxy-3-[(3S)-3-[(1R,2R)-2-(tert-butoxycarbonylamino)-1-hydroxy-3-triisopropylsilyloxy-propyl]-3-hydroxy-2-keto-indolin-7-yl]phenyl]-2-(benzyloxycarbonylamino)propanoyl]amino]-4-keto-butyric acid tert-butyl ester Formula: C57H77N5O13Si MolecularWeight: 1068.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[Si](C(C)C)(C(C)C)OCC(C(C1(C2=CC=CC(=C2NC1=O)C3=C(C=CC(=C3)CC(C(=O)NC(CC(=O)N)C(=O)OC(C)(C)C)NC(=O)OCC4=CC=CC=C4)OCC5=CC=CC=C5)O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[Si](C(C)C)(C(C)C)OC[C@H]([C@H]([C@]1(C2=CC=CC(=C2NC1=O)C3=C(C=CC(=C3)C[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)OC(C)(C)C)NC(=O)OCC4=CC=CC=C4)OCC5=CC=CC=C5)O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C57H77N5O13Si/c1-34(2)76(35(3)4,36(5)6)73-33-45(61-54(69)75-56(10,11)12)49(64)57(70)42-25-19-24-40(48(42)62-52(57)67)41-28-39(26-27-46(41)71-31-37-20-15-13-16-21-37)29-43(60-53(68)72-32-38-22-17-14-18-23-38)50(65)59-44(30-47(58)63)51(66)74-55(7,8)9/h13-28,34-36,43-45,49,64,70H,29-33H2,1-12H3,(H2,58,63)(H,59,65)(H,60,68)(H,61,69)(H,62,67)/t43-,44-,45+,49+,57-/m0/s1