CHEBI:118953 - 4-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]benzenesulfonamide

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ChEBI Name 4-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]benzenesulfonamide
ChEBI ID CHEBI:118953
Stars This entity has been manually annotated by a third party.
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Formula C24H28FN3O5S
Net Charge 0
Average Mass 489.562
Monoisotopic Mass 489.17337
InChI InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23+/m0/s1
InChIKey RXWWLGBTGKBRLQ-MDNUFGMLSA-N
SMILES C1CN(CCN1C2=CC=CC=C2)C(=O)C[C@@H]3C=C[C@H]([C@H](O3)CO)NS(=O)(=O)C4=CC=C(C=C4)F
ChEBI Ontology
Outgoing 4-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]benzenesulfonamide (CHEBI:118953) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-30402 LINCS
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