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CHEBI:8330 - Ponalactone A

ChEBI IDCHEBI:8330
ChEBI NamePonalactone A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H22O6
Net Charge0
Average Mass346.379
Monoisotopic Mass346.14164
SMILES[H][C@]12O[C@@]1([H])[C@H](O)[C@]1(C)C(=O)O[C@]3([H])C=C4C(=CC(=O)O[C@@H]4C(C)C)[C@]2(C)[C@@]31[H]
InChIInChI=1S/C19H22O6/c1-7(2)12-8-5-10-14-18(3,9(8)6-11(20)24-12)16-13(25-16)15(21)19(14,4)17(22)23-10/h5-7,10,12-16,21H,1-4H3/t10-,12-,13+,14-,15+,16+,18-,19-/m1/s1
InChIKeyKDORDIOOUCRJPK-PAFIYYKWSA-N
ChEBI Ontology
Outgoing Relation(s)
Ponalactone A (CHEBI:8330) is a organic heterotricyclic compound (CHEBI:26979)
Ponalactone A (CHEBI:8330) is a organooxygen compound (CHEBI:36963)
Synonym  Source
Ponalactone AKEGG COMPOUND
Manual XrefsDatabases
C09174KEGG COMPOUND
C00000278KNApSAcK
Registry NumbersSources
CAS:33722-77-9KEGG COMPOUND