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CHEBI:96567 - 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-methylcyclohexanecarboxamide

ChEBI IDCHEBI:96567
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-methylcyclohexanecarboxamide
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DownloadsMolfile
FormulaC23H39N5O4
Net Charge0
Average Mass449.596
Monoisotopic Mass449.30020
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)CCCn2cc(nn2)CO[C@@H]1CN(C)C(=O)C1CCCCC1
InChIInChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1
InChIKeyAHKBAATWJXKTGZ-DBXWQHBBSA-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-methylcyclohexanecarboxamide (CHEBI:96567) 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-methylcyclohexanecarboxamide (CHEBI:96567) is a lactam (CHEBI:24995)
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