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CHEBI:181752 - 12-Epinapelline

ChEBI IDCHEBI:181752
ChEBI Name12-Epinapelline
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H33NO3
Net Charge0
Average Mass359.510
Monoisotopic Mass359.24604
SMILESC=C1C2CC3(C1O)C1CC4C5(C)CCC(O)C4(C1N(CC)C5)C3CC2O
InChIInChI=1S/C22H33NO3/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3
InChIKeyAZAZKLKDEOMJBJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
12-Epinapelline (CHEBI:181752) is a kaurane diterpenoid (CHEBI:53666)
IUPAC Name 
11-ethyl-13-methyl-6-methylidene-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecane-4,7,16-triol
Manual XrefsDatabases
2386628ChemSpider