(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:113387)

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CHEBI:113387 - (8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one

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ChEBI ID	CHEBI:113387
ChEBI Name	(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one
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Downloads	Molfile

Formula	C24H37N5O3
Net Charge	0
Average Mass	443.592
Monoisotopic Mass	443.28964
SMILES	Cc1ccccc1CN(C)C[C@@H]1OCc2cn(nn2)CCCC(=O)N([C@@H](C)CO)C[C@@H]1C
InChI	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1
InChIKey	RZJYZFKNZOCSJO-JTAQYXEDSA-N

ChEBI Ontology

Outgoing Relation(s)
	(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:113387) is a azamacrocycle (CHEBI:52898)
	(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:113387) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-24797	LINCS