N-[[(8S,9R)-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,3-dimethylbenzenesulfonamide (CHEBI:113282)

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CHEBI:113282 - N-[[(8S,9R)-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,3-dimethylbenzenesulfonamide

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ChEBI ID	CHEBI:113282
ChEBI Name	N-[[(8S,9R)-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,3-dimethylbenzenesulfonamide
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Downloads	Molfile

Formula	C23H35N5O5S
Net Charge	0
Average Mass	493.630
Monoisotopic Mass	493.23589
SMILES	Cc1cccc(S(=O)(=O)N(C)C[C@@H]2OCc3cn(nn3)CCCC(=O)N([C@H](C)CO)C[C@@H]2C)c1
InChI	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22-/m0/s1
InChIKey	GKHFKOWAUNRHGL-JQVVWYNYSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[[(8S,9R)-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,3-dimethylbenzenesulfonamide (CHEBI:113282) is a azamacrocycle (CHEBI:52898)
	N-[[(8S,9R)-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,3-dimethylbenzenesulfonamide (CHEBI:113282) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-24693	LINCS