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CHEBI:98550 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyran-3-yl]pyridine-4-carboxamide

ChEBI IDCHEBI:98550
ChEBI NameN-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyran-3-yl]pyridine-4-carboxamide
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DownloadsMolfile
FormulaC24H28N4O4
Net Charge0
Average Mass436.512
Monoisotopic Mass436.21106
SMILESO=C(N[C@H]1C=C[C@H](CC(=O)N2CCN(c3ccccc3)CC2)O[C@@H]1CO)c1ccncc1
InChIInChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22-/m1/s1
InChIKeyBQXPJFPCKYJDQK-BHIFYINESA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,6-dihydro-2H-pyran-3-yl]pyridine-4-carboxamide (CHEBI:98550) is a piperazines (CHEBI:26144)
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