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CHEBI:229043 - Actinolide B

ChEBI IDCHEBI:229043
ChEBI NameActinolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H28O4
Net Charge0
Average Mass284.396
Monoisotopic Mass284.19876
SMILESCCCCCCCCC/C=C1\C(=O)O[C@@](C)(OC)[C@H]1O
InChIInChI=1S/C16H28O4/c1-4-5-6-7-8-9-10-11-12-13-14(17)16(2,19-3)20-15(13)18/h12,14,17H,4-11H2,1-3H3/b13-12-/t14-,16+/m0/s1
InChIKeyHYRMWBVOZFMSIF-KJTJGNOWSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Actinolide B (CHEBI:229043) is a ketal (CHEBI:59777)
IUPAC Name 
(3Z,4S,5R)-3-decylidene-4-hydroxy-5-methoxy-5-methyloxolan-2-one
Manual XrefsDatabases
4475419ChemSpider