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CHEBI:5861 - Ichthyotherol

ChEBI IDCHEBI:5861
ChEBI NameIchthyotherol
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC12H14O2
Net Charge0
Average Mass190.242
Monoisotopic Mass190.09938
SMILESCC#CC#C/C=C/[C@@H]1OCCC[C@H]1O
InChIInChI=1S/C12H14O2/c1-2-3-4-5-6-9-12-11(13)8-7-10-14-12/h6,9,11-13H,7-8,10H2,1H3/b9-6+/t11-,12+/m1/s1
InChIKeyDTZGSVQZSHOFEV-FIRGKKCLSA-N
ChEBI Ontology
Outgoing Relation(s)
Ichthyotherol (CHEBI:5861) is a oxanes (CHEBI:46942)
Synonyms  Source
IchthyotherolKEGG COMPOUND
2H-Pyran-3-ol, tetrahydro-2-(1-nonene-3,5,7-triynyl)-, (2S-(2alpha(E),3beta))-KEGG COMPOUND
Manual XrefsDatabases
C08452KEGG COMPOUND
C00001286KNApSAcK
Registry NumbersSources
CAS:2294-61-3KEGG COMPOUND