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CHEBI:7453 - Nagilactone C

ChEBI IDCHEBI:7453
ChEBI NameNagilactone C
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H22O7
Net Charge0
Average Mass362.378
Monoisotopic Mass362.13655
SMILES[H][C@]12O[C@@]1([H])[C@H](O)[C@]1(C)C(=O)O[C@]3([H])[C@H](O)c4c(cc(=O)oc4C(C)C)[C@]2(C)[C@]13[H]
InChIInChI=1S/C19H22O7/c1-6(2)11-9-7(5-8(20)24-11)18(3)14-12(10(9)21)26-17(23)19(14,4)15(22)13-16(18)25-13/h5-6,10,12-16,21-22H,1-4H3/t10-,12-,13+,14-,15+,16+,18-,19-/m1/s1
InChIKeyDGNOPGIIPQKNHD-PAFIYYKWSA-N
ChEBI Ontology
Outgoing Relation(s)
Nagilactone C (CHEBI:7453) is a organic heterotricyclic compound (CHEBI:26979)
Nagilactone C (CHEBI:7453) is a organooxygen compound (CHEBI:36963)
Synonym  Source
Nagilactone CKEGG COMPOUND
Manual XrefsDatabases
C09138KEGG COMPOUND
C00000270KNApSAcK
Registry NumbersSources
CAS:24338-53-2KEGG COMPOUND