CHEBI:123493 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]-1-methyl-4-imidazolesulfonamide

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ChEBI Name N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]-1-methyl-4-imidazolesulfonamide
ChEBI ID CHEBI:123493
Stars This entity has been manually annotated by a third party.
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Formula C22H31N5O5S
Net Charge 0
Average Mass 477.579
Monoisotopic Mass 477.20459
InChI InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20+/m0/s1
InChIKey RVDWTGCIOVVFDR-SLFFLAALSA-N
SMILES CN1C=C(N=C1)S(=O)(=O)N[C@H]2CC[C@H](O[C@@H]2CO)CC(=O)N3CCN(CC3)C4=CC=CC=C4
ChEBI Ontology
Outgoing N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]-1-methyl-4-imidazolesulfonamide (CHEBI:123493) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-34935 LINCS
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