CHEBI:108795 - N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide

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ChEBI Name N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide
ChEBI ID CHEBI:108795
Stars This entity has been manually annotated by a third party.
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Formula C24H34N4O5S
Net Charge 0
Average Mass 490.618
Monoisotopic Mass 490.22499
InChI InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23-/m0/s1
InChIKey ZIGDOLRJGHLEBT-BSRJHKFKSA-N
SMILES C[C@H]1CN(C(=O)CC2=C(C=CC(=C2)NS(=O)(=O)C)O[C@H]1CN(C)CC3=CC=NC=C3)[C@@H](C)CO
ChEBI Ontology
Outgoing N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide (CHEBI:108795) is a sulfonamide (CHEBI:35358)
Manual Xref Database
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