EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:187056 - 3S,7S-dimethyl-2S-tridecanol

ChEBI IDCHEBI:187056
ChEBI Name3S,7S-dimethyl-2S-tridecanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H32O
Net Charge0
Average Mass228.420
Monoisotopic Mass228.24532
SMILESCCCCCC[C@H](C)CCC[C@H](C)[C@H](C)O
InChIInChI=1S/C15H32O/c1-5-6-7-8-10-13(2)11-9-12-14(3)15(4)16/h13-16H,5-12H2,1-4H3/t13-,14-,15-/m0/s1
InChIKeyGSOHTXXXDWFCAJ-KKUMJFAQSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
3S,7S-dimethyl-2S-tridecanol (CHEBI:187056) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(2S,3S,7S)-3,7-dimethyltridecan-2-ol
Manual XrefsDatabases
LMFA05000036LIPID MAPS
4446409ChemSpider