N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide (CHEBI:97045)

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CHEBI:97045 - N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

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ChEBI ID	CHEBI:97045
ChEBI Name	N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide
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Downloads	Molfile

Formula	C23H35N5O6S
Net Charge	0
Average Mass	509.629
Monoisotopic Mass	509.23080
SMILES	COc1cccc(S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N([C@@H](C)CO)C[C@@H]2C)c1
InChI	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m0/s1
InChIKey	IZYFSJYDPLTURU-SPEDKVCISA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide (CHEBI:97045) is a azamacrocycle (CHEBI:52898)
	N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide (CHEBI:97045) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-8424	LINCS