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CHEBI:2565 - Alectrol

ChEBI IDCHEBI:2565
ChEBI NameAlectrol
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H22O6
Net Charge0
Average Mass346.379
Monoisotopic Mass346.14164
SMILES[H][C@]1(O/C=C2/C(=O)O[C@]3([H])C4(O)C(=C[C@]23[H])CCCC4(C)C)C=C(C)C(=O)O1
InChIInChI=1S/C19H22O6/c1-10-7-14(24-16(10)20)23-9-13-12-8-11-5-4-6-18(2,3)19(11,22)15(12)25-17(13)21/h7-9,12,14-15,22H,4-6H2,1-3H3/b13-9+/t12-,14-,15+,19?/m1/s1
InChIKeyFIKOOQXJBAJJSE-YTQTXRHFSA-N
ChEBI Ontology
Outgoing Relation(s)
Alectrol (CHEBI:2565) is a γ-lactone (CHEBI:37581)
Synonym  Source
AlectrolKEGG COMPOUND
Manual XrefsDatabases
C09059KEGG COMPOUND
C00003401KNApSAcK
Registry NumbersSources
CAS:143572-84-3KEGG COMPOUND