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CHEBI:96742 - (8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

ChEBI IDCHEBI:96742
ChEBI Name(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
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DownloadsMolfile
FormulaC29H39N5O3
Net Charge0
Average Mass505.663
Monoisotopic Mass505.30529
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(-c3ccccc3)cc2)OCc2cnnn2CCCC1=O
InChIInChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m0/s1
InChIKeyYAZCQYURBLEIHO-JWZKTCGFSA-N
ChEBI Ontology
Outgoing Relation(s)
(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:96742) is a azamacrocycle (CHEBI:52898)
(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:96742) is a lactam (CHEBI:24995)
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