Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 07:03:06 UTC
Update Date2022-08-31 06:40:56 UTC
MiMeDB IDMMDBc0016392
Metabolite Identification
Common Name(1R,2S,3R,4S,5S)-2,3-epoxy-5-methylcyclohexane-1,4-diol
DescriptionCHEMBL2419347 belongs to the class of organic compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms. Based on a literature review very few articles have been published on CHEMBL2419347.
Structure
SynonymsNot Available
Chemical FormulaC7H12O3
Average Molecular Weight144.17
Monoisotopic Molecular Weight144.078644246
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C7H12O3/c1-3-2-4(8)6-7(10-6)5(3)9/h3-9H,2H2,1H3/t3-,4+,5-,6-,7+/m0/s1
InChI KeyCMZGQDPCPWKPGY-MLKOFDEISA-N