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CHEBI:122331 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]benzamide

Default Structure
ChEBI IDCHEBI:122331
ChEBI NameN-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]benzamide
Stars
DownloadsMolfile
FormulaC20H22N4O4
Net Charge0
Average Mass382.420
Monoisotopic Mass382.16411
SMILESO=C(C[C@H]1C=C[C@H](NC(=O)c2ccccc2)[C@@H](CO)O1)NCc1ccncn1
InChIInChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18-/m1/s1
InChIKeyJMJYAJMXQVZTFW-FGTMMUONSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]benzamide (CHEBI:122331) is a benzamides (CHEBI:22702)
Manual XrefsDatabases
LSM-33774LINCS