[(2S,3S)-1-[[2-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[4,4-dimethyl-5-[methyl-[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-3,5-bis(oxidanylidene)pentan-2-yl]amino]-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl] (2S,3R)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: [(2S,3S)-1-[[2-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[4,4-dimethyl-5-[methyl-[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-3,5-bis(oxidanylidene)pentan-2-yl]amino]-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl] (2S,3R)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: [(1S,2S)-1-[[2-[[(1S)-1-[[2-[[(1S)-1-[[(1S)-2-[[4-[[(1S)-2-benzyloxy-1-methyl-2-oxo-ethyl]-methyl-amino]-1,3,3-trimethyl-2,4-dioxo-butyl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-methyl-carbamoyl]-2-methyl-propyl]-methyl-amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]-methyl-amino]-2-oxo-ethyl]carbamoyl]-2-methyl-butyl] (2S,3R)-3-(tert-butoxycarbonylamino)-2-methyl-pentanoate CAS Name: (2S,3R)-2-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid [(2S,3S)-1-[[2-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[4,4-dimethyl-5-[methyl-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]amino]-3,5-dioxopentan-2-yl]amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]-methylamino]-2-oxoethyl]amino]-3-methyl-1-oxopentan-2-yl] ester IUPAC Name: [(2S,3S)-1-[[2-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[4,4-dimethyl-5-[methyl-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]amino]-3,5-dioxopentan-2-yl]amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]-methylamino]-2-oxoethyl]amino]-3-methyl-1-oxopentan-2-yl] (2S,3R)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S,3R)-3-(tert-butoxycarbonylamino)-2-methyl-valeric acid [(1S,2S)-1-[[2-[[(1S)-1-[[2-[[(1S)-1-[[(1S)-2-[[4-[[(1S)-2-benzoxy-2-keto-1-methyl-ethyl]-methyl-amino]-2,4-diketo-1,3,3-trimethyl-butyl]amino]-2-keto-1-p-anisyl-ethyl]-methyl-carbamoyl]-2-methyl-propyl]-methyl-amino]-2-keto-ethyl]carbamoyl]-3-methyl-butyl]-methyl-amino]-2-keto-ethyl]carbamoyl]-2-methyl-butyl] ester Formula: C63H98N8O15 MolecularWeight: 1207.49682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(=O)N(C)C(CC(C)C)C(=O)NCC(=O)N(C)C(C(C)C)C(=O)N(C)C(CC1=CC=C(C=C1)OC)C(=O)NC(C)C(=O)C(C)(C)C(=O)N(C)C(C)C(=O)OCC2=CC=CC=C2)OC(=O)C(C)C(CC)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C63H98N8O15/c1-21-39(7)52(85-58(79)40(8)46(22-2)67-61(82)86-62(11,12)13)56(77)65-34-49(72)69(17)47(32-37(3)4)54(75)64-35-50(73)71(19)51(38(5)6)57(78)70(18)48(33-43-28-30-45(83-20)31-29-43)55(76)66-41(9)53(74)63(14,15)60(81)68(16)42(10)59(80)84-36-44-26-24-23-25-27-44/h23-31,37-42,46-48,51-52H,21-22,32-36H2,1-20H3,(H,64,75)(H,65,77)(H,66,76)(H,67,82)/t39-,40-,41?,42-,46+,47-,48-,51-,52-/m0/s1