2-[(E)-C-[5-[3-[2-[[6-(2-methylpropyl)-7-(oxidanylcarbamoyl)-5-oxidanylidene-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-trien-3-yl]carbonylamino]ethanoylamino]propylcarbamoyl]pyridin-2-yl]carbonohydrazonoyl]benzenesulfonic acid

Systemtic Name: 2-[(E)-C-[5-[3-[2-[[6-(2-methylpropyl)-7-(oxidanylcarbamoyl)-5-oxidanylidene-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-trien-3-yl]carbonylamino]ethanoylamino]propylcarbamoyl]pyridin-2-yl]carbonohydrazonoyl]benzenesulfonic acid Openeye Name: 2-[(E)-[5-[3-[[2-[[7-(hydroxycarbamoyl)-6-isobutyl-5-oxo-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carbonyl]amino]acetyl]amino]propylcarbamoyl]-2-pyridyl]carbonohydrazonoyl]benzenesulfonic acid CAS Name: 2-[(E)-hydrazinylidene-[5-[[3-[[2-[[[7-[(hydroxyamino)-oxomethyl]-6-(2-methylpropyl)-5-oxo-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-trien-3-yl]-oxomethyl]amino]-1-oxoethyl]amino]propylamino]-oxomethyl]-2-pyridinyl]methyl]benzenesulfonic acid IUPAC Name: 2-[(E)-C-[5-[3-[[2-[[7-(hydroxycarbamoyl)-6-(2-methylpropyl)-5-oxo-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carbonyl]amino]acetyl]amino]propylcarbamoyl]pyridin-2-yl]carbonohydrazonoyl]benzenesulfonic acid Traditional Name: 2-[(E)-[5-[3-[[2-[[7-(hydroxycarbamoyl)-6-isobutyl-5-keto-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carbonyl]amino]acetyl]amino]propylcarbamoyl]-2-pyridyl]carbohydrazonoyl]besylic acid Formula: C38H48N8O10S MolecularWeight: 808.90032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(CCCOC2=CC=C(CC(NC1=O)C(=O)NCC(=O)NCCCNC(=O)C3=CN=C(C=C3)C(=NN)C4=CC=CC=C4S(=O)(=O)O)C=C2)C(=O)NO

Isomeric SMILES

CC(C)CC1C(CCCOC2=CC=C(CC(NC1=O)C(=O)NCC(=O)NCCCNC(=O)C3=CN=C(C=C3)/C(=N/N)/C4=CC=CC=C4S(=O)(=O)O)C=C2)C(=O)NO

InChI

InChI=1S/C38H48N8O10S/c1-23(2)19-29-27(37(50)46-52)8-5-18-56-26-13-10-24(11-14-26)20-31(44-36(29)49)38(51)43-22-33(47)40-16-6-17-41-35(48)25-12-15-30(42-21-25)34(45-39)28-7-3-4-9-32(28)57(53,54)55/h3-4,7,9-15,21,23,27,29,31,52H,5-6,8,16-20,22,39H2,1-2H3,(H,40,47)(H,41,48)(H,43,51)(H,44,49)(H,46,50)(H,53,54,55)/b45-34+