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CHEBI:118300 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

ChEBI IDCHEBI:118300
ChEBI NameN-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide
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DownloadsMolfile
FormulaC22H25N3O4
Net Charge0
Average Mass395.459
Monoisotopic Mass395.18451
SMILESC[C@@H](NC(=O)C[C@H]1C=C[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1
InChIInChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m1/s1
InChIKeyOQCXBRWJDZLXCP-GEALJGNFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide (CHEBI:118300) has functional parent nicotinamide (CHEBI:17154)
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide (CHEBI:118300) is a pyridinecarboxamide (CHEBI:25529)
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