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CHEBI:81102 - Paeonilactone C

ChEBI IDCHEBI:81102
ChEBI NamePaeonilactone C
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DownloadsMolfile
FormulaC17H18O6
Net Charge0
Average Mass318.325
Monoisotopic Mass318.11034
SMILES[H][C@@]12C[C@](C)(O)C(=O)C[C@]1([H])[C@@H](COC(=O)c1ccccc1)C(=O)O2
InChIInChI=1S/C17H18O6/c1-17(21)8-13-11(7-14(17)18)12(16(20)23-13)9-22-15(19)10-5-3-2-4-6-10/h2-6,11-13,21H,7-9H2,1H3/t11-,12-,13-,17+/m1/s1
InChIKeyBDKBBWGLLDEQEV-ZFRZLUBXSA-N
ChEBI Ontology
Outgoing Relation(s)
Paeonilactone C (CHEBI:81102) is a benzoate ester (CHEBI:36054)
Manual XrefsDatabases
C17456KEGG COMPOUND