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CHEBI:96870 - (8S,9S)-9-[[cyclohexylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one

ChEBI IDCHEBI:96870
ChEBI Name(8S,9S)-9-[[cyclohexylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one
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DownloadsMolfile
FormulaC23H41N5O3
Net Charge0
Average Mass435.613
Monoisotopic Mass435.32094
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCc2cn(nn2)CCCC1=O
InChIInChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1
InChIKeyZIMKOTFORJXDIC-NNMXDRDESA-N
ChEBI Ontology
Outgoing Relation(s)
(8S,9S)-9-[[cyclohexylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:96870) is a azamacrocycle (CHEBI:52898)
(8S,9S)-9-[[cyclohexylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:96870) is a lactam (CHEBI:24995)
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