CHEBI:98038 - N-[(2R,3R)-4-[benzenesulfonyl-[(2R)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methyloxane-4-carboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2R,3R)-4-[benzenesulfonyl-[(2R)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methyloxane-4-carboxamide
ChEBI ID CHEBI:98038
Stars This entity has been manually annotated by a third party.
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Formula C22H36N2O6S
Net Charge 0
Average Mass 456.598
Monoisotopic Mass 456.22941
InChI InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21+/m1/s1
InChIKey SLHJHGLJXJFOQY-OPYAIIAOSA-N
SMILES C[C@H](CN([C@H](C)CO)S(=O)(=O)C1=CC=CC=C1)[C@H](CN(C)C(=O)C2CCOCC2)OC
ChEBI Ontology
Outgoing N-[(2R,3R)-4-[benzenesulfonyl-[(2R)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methyloxane-4-carboxamide (CHEBI:98038) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-9417 LINCS
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