EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:134012 - artemoin C

ChEBI IDCHEBI:134012
ChEBI Nameartemoin C
Stars
DefinitionAn artemoin in which the two hydroxy groups on the C-30 side-chain are located at positions 15 and 16.
Last Modified16 May 2017
SubmitterKeeva
DownloadsMolfile
FormulaC35H66O4
Net Charge0
Average Mass550.909
Monoisotopic Mass550.49611
SMILESCCCCCCCCCCCCCCC(O)C(O)CCCCCCCCCCCCCCC1=CC(C)OC1=O
InChIInChI=1S/C35H66O4/c1-3-4-5-6-7-8-9-13-16-19-22-25-28-33(36)34(37)29-26-23-20-17-14-11-10-12-15-18-21-24-27-32-30-31(2)39-35(32)38/h30-31,33-34,36-37H,3-29H2,1-2H3
InChIKeyMBDVKGSWKNHBQZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Annona atemoya (IPNI:1006408-1) seed (BTO:0001226) DOI (10.1016/S0031-9422(99)00142-9)
Rattus norvegicus (ncbitaxon:10116) - MetaboLights (MTBLS313)
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS313)
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
artemoin C (CHEBI:134012) has role mouse metabolite (CHEBI:75771)
artemoin C (CHEBI:134012) has role plant metabolite (CHEBI:76924)
artemoin C (CHEBI:134012) has role rat metabolite (CHEBI:86264)
artemoin C (CHEBI:134012) is a artemoin (CHEBI:134234)
IUPAC Name 
3-(15,16-dihydroxytriacontyl)-5-methylfuran-2(5H)-one
Synonym  Source
3-(15,16-Dihydroxytriacontyl)-5-methyl-2(5H)-furanoneHMDB
Manual XrefsDatabases
HMDB0033606HMDB
Registry NumbersSources
Reaxys:8301083Reaxys