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CHEBI:197177 - 14-methyl-20,14-retro-retinoic acid

Default Structure
ChEBI IDCHEBI:197177
ChEBI Name14-methyl-20,14-retro-retinoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O2
Net Charge0
Average Mass314.469
Monoisotopic Mass314.22458
SMILESC=C(/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C)C(C)C(=O)O
InChIInChI=1S/C21H30O2/c1-15(9-7-10-16(2)18(4)20(22)23)12-13-19-17(3)11-8-14-21(19,5)6/h7,9-10,12-13,18H,2,8,11,14H2,1,3-6H3,(H,22,23)/b10-7+,13-12+,15-9+
InChIKeyJVNZTBXNNSQXJS-FGKSVAIXSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
14-methyl-20,14-retro-retinoic acid (CHEBI:197177) is a retinoid (CHEBI:26537)
IUPAC Name 
(4E,6E,8E)-2,7-dimethyl-3-methylidene-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6,8-trienoic acid
Manual XrefsDatabases
23224982ChemSpider
LMPR01090033LIPID MAPS