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CHEBI:96013 - N-[[(8S,9R)-6-[(2S)-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-methyl-4-(4-methyl-1-piperazinyl)benzamide

ChEBI IDCHEBI:96013
ChEBI NameN-[[(8S,9R)-6-[(2S)-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-methyl-4-(4-methyl-1-piperazinyl)benzamide
Stars
DownloadsMolfile
FormulaC28H43N7O4
Net Charge0
Average Mass541.697
Monoisotopic Mass541.33765
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)CCCn2cc(nn2)CO[C@H]1CN(C)C(=O)c1ccc(N2CCN(C)CC2)cc1
InChIInChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26-/m0/s1
InChIKeyOIASBGFOQSUHIL-MCEYFSPLSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(8S,9R)-6-[(2S)-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-methyl-4-(4-methyl-1-piperazinyl)benzamide (CHEBI:96013) is a azamacrocycle (CHEBI:52898)
N-[[(8S,9R)-6-[(2S)-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-methyl-4-(4-methyl-1-piperazinyl)benzamide (CHEBI:96013) is a lactam (CHEBI:24995)
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