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CHEBI:213350 - CJ-16,169

ChEBI IDCHEBI:213350
ChEBI NameCJ-16,169
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H21NO3
Net Charge0
Average Mass311.381
Monoisotopic Mass311.15214
SMILESC/C=C(\C)[C@H]1Oc2ncc(-c3ccccc3)c(=O)c2[C@@]1(C)CO
InChIInChI=1S/C19H21NO3/c1-4-12(2)17-19(3,11-21)15-16(22)14(10-20-18(15)23-17)13-8-6-5-7-9-13/h4-10,17,21H,11H2,1-3H3,(H,20,22)/b12-4+/t17-,19-/m1/s1
InChIKeyBJRAMQBZNGBNLY-LTVUSIFUSA-N
Species of MetaboliteComponentSourceComments
Cladobotryum (ncbitaxon:73504) - PubMed (11918067)
ChEBI Ontology
Outgoing Relation(s)
CJ-16,169 (CHEBI:213350) is a phenylpyridine (CHEBI:38193)
IUPAC Name 
(2R,3S)-2-[(E)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-5-phenyl-2,7-dihydrouro[2,3-b]pyridin-4-one
Manual XrefsDatabases
9056757ChemSpider