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CHEBI:96982 - N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylmethanesulfonamide

ChEBI IDCHEBI:96982
ChEBI NameN-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylmethanesulfonamide
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DownloadsMolfile
FormulaC17H31N5O5S
Net Charge0
Average Mass417.532
Monoisotopic Mass417.20459
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)CCCn2cc(nn2)CO[C@@H]1CN(C)S(C)(=O)=O
InChIInChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1
InChIKeyPUHFBKBPROGAIN-IIAWOOMASA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylmethanesulfonamide (CHEBI:96982) is a azamacrocycle (CHEBI:52898)
N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methylmethanesulfonamide (CHEBI:96982) is a lactam (CHEBI:24995)
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