EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:199555 - MKN-004C

ChEBI IDCHEBI:199555
ChEBI NameMKN-004C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H18O3
Net Charge0
Average Mass186.251
Monoisotopic Mass186.12559
SMILESCC(C)CC[C@@H]1C(=O)O[C@@H](C)[C@@H]1O
InChIInChI=1S/C10H18O3/c1-6(2)4-5-8-9(11)7(3)13-10(8)12/h6-9,11H,4-5H2,1-3H3/t7-,8-,9-/m0/s1
InChIKeyKBJCRTCKPJQWOP-CIUDSAMLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (11374972)
ChEBI Ontology
Outgoing Relation(s)
MKN-004C (CHEBI:199555) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(3S,4R,5S)-4-hydroxy-5-methyl-3-(3-methylbutyl)oxolan-2-one
Manual XrefsDatabases
9216623ChemSpider