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CHEBI:174313 - Pandamarilactonine A

ChEBI IDCHEBI:174313
ChEBI NamePandamarilactonine A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23NO4
Net Charge0
Average Mass317.385
Monoisotopic Mass317.16271
SMILESCC1=CC(=CCCCN2CCCC2C2C=C(C)C(=O)O2)OC1=O
InChIInChI=1S/C18H23NO4/c1-12-10-14(22-17(12)20)6-3-4-8-19-9-5-7-15(19)16-11-13(2)18(21)23-16/h6,10-11,15-16H,3-5,7-9H2,1-2H3
InChIKeyHSICZNIIIPFAAO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Pandamarilactonine A (CHEBI:174313) is a butenolide (CHEBI:50523)
IUPAC Name 
3-methyl-5-[4-[2-(4-methyl-5-oxo-2H-uran-2-yl)pyrrolidin-1-yl]butylidene]uran-2-one
Manual XrefsDatabases
74078138ChemSpider