EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:114150 - N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-(3-pyridinyl)acetamide

ChEBI IDCHEBI:114150
ChEBI NameN-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-(3-pyridinyl)acetamide
Stars
DownloadsMolfile
FormulaC29H34N4O5
Net Charge0
Average Mass518.614
Monoisotopic Mass518.25292
SMILESCOc1ccc(-c2cnc3c(c2)C(=O)N([C@H](C)CO)C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)O3)cc1
InChIInChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26-/m0/s1
InChIKeyYLZPYRGVLPKCNQ-UNVFRBQDSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(4-methoxyphenyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-(3-pyridinyl)acetamide (CHEBI:114150) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-25581LINCS