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CHEBI:226050 - Oudemansinol B

ChEBI IDCHEBI:226050
ChEBI NameOudemansinol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H21ClO5
Net Charge0
Average Mass340.803
Monoisotopic Mass340.10775
SMILESCOC(=O)/C(CO)=C(/C)[C@H](/C=C/c1ccc(Cl)c(OC)c1)OC
InChIInChI=1S/C17H21ClO5/c1-11(13(10-19)17(20)23-4)15(21-2)8-6-12-5-7-14(18)16(9-12)22-3/h5-9,15,19H,10H2,1-4H3/b8-6+,13-11-/t15-/m0/s1
InChIKeyAFKURGPQTTYSEG-JHDFNDJQSA-N
Species of MetaboliteComponentSourceComments
Favolaschia (ncbitaxon:139071) - PubMed (32193929)
ChEBI Ontology
Outgoing Relation(s)
Oudemansinol B (CHEBI:226050) is a methoxybenzenes (CHEBI:51683)
IUPAC Name 
methyl (2Z,4S,5E)-6-(4-chloro-3-methoxyphenyl)-2-(hydroxymethyl)-4-methoxy-3-methylhexa-2,5-dienoate