CHEBI:212791 - 3-Methyltridecan-4-one

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 3-Methyltridecan-4-one
ChEBI ID CHEBI:212791
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H28O
Net Charge 0
Average Mass 212.377
Monoisotopic Mass 212.21402
InChI InChI=1S/C14H28O/c1-4-6-7-8-9-10-11-12-14(15)13(3)5-2/h13H,4-12H2,1-3H3/t13-/m0/s1
InChIKey MTDKYNCGFZGFIY-ZDUSSCGKSA-N
SMILES O=C([C@H](CC)C)CCCCCCCCC
Metabolite of Species Details
Myxococcus xanthus DK 1622 (NCBI:txid246197) See: PubMed
ChEBI Ontology
Outgoing 3-Methyltridecan-4-one (CHEBI:212791) is a ketone (CHEBI:17087)
IUPAC Name
3-methyltridecan-4-one
Manual Xref Database
43715642 ChemSpider
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