[(3R,5S)-5-[[(2S)-6-azanyl-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]carbamoyl]-1-[(2S)-2-[[(2S)-2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]pyrrolidin-3-yl] sulfate; tetrabutylazanium

Systemtic Name: [(3R,5S)-5-[[(2S)-6-azanyl-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]carbamoyl]-1-[(2S)-2-[[(2S)-2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]pyrrolidin-3-yl] sulfate; tetrabutylazanium Openeye Name: [(3R,5S)-5-[[(1S)-5-amino-1-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]pentyl]carbamoyl]-1-[(2S)-2-[[(2S)-2-amino-5-hydroxy-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]pyrrolidin-3-yl] sulfate; tetrabutylammonium CAS Name: [(3R,5S)-5-[[[(2S)-6-amino-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]amino]-oxomethyl]-1-[(2S)-2-[[(2S)-2-amino-5-hydroxy-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]-3-pyrrolidinyl] sulfate; tetrabutylammonium IUPAC Name: [(3R,5S)-5-[[(2S)-6-amino-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]carbamoyl]-1-[(2S)-2-[[(2S)-2-amino-5-hydroxy-5-oxopentanoyl]amino]-4-methylpentanoyl]pyrrolidin-3-yl] sulfate; tetrabutylazanium Traditional Name: [(3R,5S)-5-[[(1S)-5-amino-1-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]carbamoyl]pentyl]carbamoyl]-1-[(2S)-2-[[(2S)-2-amino-5-hydroxy-5-keto-pentanoyl]amino]-4-methyl-pentanoyl]pyrrolidin-3-yl] sulfate; tetrabutylammonium Formula: C47H84N8O11S MolecularWeight: 969.28186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CC(C)CC(C(=O)N1CC(CC1C(=O)NC(CCCCN)C(=O)NC(CC2=CC=CC=C2)C(=O)N)OS(=O)(=O)[O-])NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CC(C)C[C@@H](C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N)OS(=O)(=O)[O-])NC(=O)[C@H](CCC(=O)O)N

InChI

InChI=1S/C31H49N7O11S.C16H36N/c1-18(2)14-24(37-28(42)21(33)11-12-26(39)40)31(45)38-17-20(49-50(46,47)48)16-25(38)30(44)35-22(10-6-7-13-32)29(43)36-23(27(34)41)15-19-8-4-3-5-9-19;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h3-5,8-9,18,20-25H,6-7,10-17,32-33H2,1-2H3,(H2,34,41)(H,35,44)(H,36,43)(H,37,42)(H,39,40)(H,46,47,48);5-16H2,1-4H3/q;+1/p-1/t20-,21+,22+,23+,24+,25+;/m1./s1