EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:174254 - L-Menthyl (R,S)-3-hydroxybutyrate

ChEBI IDCHEBI:174254
ChEBI NameL-Menthyl (R,S)-3-hydroxybutyrate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H26O3
Net Charge0
Average Mass242.359
Monoisotopic Mass242.18819
SMILESCC(O)CC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C
InChIInChI=1S/C14H26O3/c1-9(2)12-6-5-10(3)7-13(12)17-14(16)8-11(4)15/h9-13,15H,5-8H2,1-4H3/t10-,11?,12+,13-/m1/s1
InChIKeyXSJPRWBZLUYOOI-IBSWDFHHSA-N
ChEBI Ontology
Outgoing Relation(s)
L-Menthyl (R,S)-3-hydroxybutyrate (CHEBI:174254) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name 
[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-hydroxybutanoate
Manual XrefsDatabases
8395936ChemSpider
HMDB0032370HMDB
Registry NumbersSources
CAS:374629-79-5ChemIDplus