EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:122246 - 2-[(2S,5S,6S)-5-[[2-(dimethylamino)-1-oxoethyl]amino]-6-(hydroxymethyl)-2-oxanyl]-N-[(4-methoxyphenyl)methyl]acetamide

ChEBI IDCHEBI:122246
ChEBI Name2-[(2S,5S,6S)-5-[[2-(dimethylamino)-1-oxoethyl]amino]-6-(hydroxymethyl)-2-oxanyl]-N-[(4-methoxyphenyl)methyl]acetamide
Stars
DownloadsMolfile
FormulaC20H31N3O5
Net Charge0
Average Mass393.484
Monoisotopic Mass393.22637
SMILESCOc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1
InChIInChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1
InChIKeyAFXALTHXBUYGQN-OKZBNKHCSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(2S,5S,6S)-5-[[2-(dimethylamino)-1-oxoethyl]amino]-6-(hydroxymethyl)-2-oxanyl]-N-[(4-methoxyphenyl)methyl]acetamide (CHEBI:122246) is a amino acid amide (CHEBI:22475)
Manual XrefsDatabases
LSM-33689LINCS