CHEBI:212830 - (6R,10S)-10-methyl-6-dodecanolide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (6R,10S)-10-methyl-6-dodecanolide
ChEBI ID CHEBI:212830
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H24O2
Net Charge 0
Average Mass 212.333
Monoisotopic Mass 212.17763
InChI InChI=1S/C13H24O2/c1-3-11(2)7-6-9-12-8-4-5-10-13(14)15-12/h11-12H,3-10H2,1-2H3/t11-,12+/m0/s1
InChIKey FWCJVEHVQQNKBH-NWDGAFQWSA-N
SMILES O=C1O[C@H](CCCC1)CCC[C@H](CC)C
Metabolite of Species Details
Streptomycesspecies (NCBI:txid1931) See: PubMed
ChEBI Ontology
Outgoing (6R,10S)-10-methyl-6-dodecanolide (CHEBI:212830) is a lactone (CHEBI:25000)
IUPAC Name
(7R)-7-[(4S)-4-methylhexyl]oxepan-2-one
Manual Xref Database
8551344 ChemSpider
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