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CHEBI:108616 - N-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide

ChEBI IDCHEBI:108616
ChEBI NameN-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide
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DownloadsMolfile
FormulaC22H35N3O5S
Net Charge0
Average Mass453.605
Monoisotopic Mass453.22974
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O
InChIInChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16+,21+/m0/s1
InChIKeyLKTOUOMEFKMKTF-GCKMJXCFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide (CHEBI:108616) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-20016LINCS