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CHEBI:126715 - N'-(2-aminophenyl)-N-[(2S,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]heptanediamide

ChEBI IDCHEBI:126715
ChEBI NameN'-(2-aminophenyl)-N-[(2S,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]heptanediamide
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FormulaC36H46ClN5O7S
Net Charge0
Average Mass728.312
Monoisotopic Mass727.28065
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)CCCCCC(=O)Nc3ccccc3N)cc2CC1=O
InChIInChI=1S/C36H46ClN5O7S/c1-24-21-42(25(2)23-43)36(46)20-26-19-28(39-34(44)11-5-4-6-12-35(45)40-31-10-8-7-9-30(31)38)15-18-32(26)49-33(24)22-41(3)50(47,48)29-16-13-27(37)14-17-29/h7-10,13-19,24-25,33,43H,4-6,11-12,20-23,38H2,1-3H3,(H,39,44)(H,40,45)/t24-,25+,33+/m0/s1
InChIKeyZPDAXSAOPWEADL-JQASONJCSA-N
ChEBI Ontology
Outgoing Relation(s)
N'-(2-aminophenyl)-N-[(2S,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]heptanediamide (CHEBI:126715) is a sulfonamide (CHEBI:35358)
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