[(2S)-4-oxidanylidene-4-[[(3S)-1-oxidanyl-2-oxidanylidene-azepan-3-yl]amino]butan-2-yl] (2S)-6-[hexadecanoyl(oxidanyl)amino]-2-[[(2E,4S)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,3-oxazolidin-4-yl]carbonylamino]hexanoate

Systemtic Name: [(2S)-4-oxidanylidene-4-[[(3S)-1-oxidanyl-2-oxidanylidene-azepan-3-yl]amino]butan-2-yl] (2S)-6-[hexadecanoyl(oxidanyl)amino]-2-[[(2E,4S)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,3-oxazolidin-4-yl]carbonylamino]hexanoate Openeye Name: [(1S)-3-[[(3S)-1-hydroxy-2-oxo-azepan-3-yl]amino]-1-methyl-3-oxo-propyl] (2S)-6-[hexadecanoyl(hydroxy)amino]-2-[[(2E,4S)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)oxazolidine-4-carbonyl]amino]hexanoate CAS Name: (2S)-6-[hydroxy(1-oxohexadecyl)amino]-2-[[oxo-[(2E,4S)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-oxazolidinyl]methyl]amino]hexanoic acid [(2S)-4-[[(3S)-1-hydroxy-2-oxo-3-azepanyl]amino]-4-oxobutan-2-yl] ester IUPAC Name: [(2S)-4-[[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino]-4-oxobutan-2-yl] (2S)-6-[hexadecanoyl(hydroxy)amino]-2-[[(2E,4S)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,3-oxazolidine-4-carbonyl]amino]hexanoate Traditional Name: (2S)-6-[hexadecanoyl(hydroxy)amino]-2-[[(2E,4S)-2-(6-ketocyclohexa-2,4-dien-1-ylidene)oxazolidine-4-carbonyl]amino]hexanoic acid [(1S)-3-[[(3S)-1-hydroxy-2-keto-azepan-3-yl]amino]-3-keto-1-methyl-propyl] ester Formula: C42H67N5O10 MolecularWeight: 802.00888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(CCCCC(C(=O)OC(C)CC(=O)NC1CCCCN(C1=O)O)NC(=O)C2COC(=C3C=CC=CC3=O)N2)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(CCCC[C@@H](C(=O)O[C@@H](C)CC(=O)N[C@H]1CCCCN(C1=O)O)NC(=O)[C@@H]2CO/C(=C/3\C=CC=CC3=O)/N2)O

InChI

InChI=1S/C42H67N5O10/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-26-38(50)46(54)27-20-19-24-34(44-39(51)35-30-56-40(45-35)32-22-16-17-25-36(32)48)42(53)57-31(2)29-37(49)43-33-23-18-21-28-47(55)41(33)52/h16-17,22,25,31,33-35,45,54-55H,3-15,18-21,23-24,26-30H2,1-2H3,(H,43,49)(H,44,51)/b40-32+/t31-,33-,34-,35-/m0/s1