N-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide (CHEBI:113563)

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CHEBI:113563 - N-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide

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ChEBI ID	CHEBI:113563
ChEBI Name	N-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
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Downloads	Molfile

Formula	C18H29N3O5S
Net Charge	0
Average Mass	399.513
Monoisotopic Mass	399.18279
SMILES	C[C@@H]1CN([C@@H](C)CO)C(=O)c2cccc(NS(C)(=O)=O)c2O[C@@H]1CN(C)C
InChI	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16-/m1/s1
InChIKey	NGOQGDZIZPAXSN-DVOMOZLQSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2S,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide (CHEBI:113563) is a sulfonamide (CHEBI:35358)

Manual Xrefs	Databases
LSM-24995	LINCS