CHEBI:85474 - 4-hydroxy-6-(2-hydroxytridecyl)-pyran-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-hydroxy-6-(2-hydroxytridecyl)-pyran-2-one
ChEBI ID CHEBI:85474
Definition A 6-alkyl-4-hydroxy-2H-pyran-2-one that is 4-hydroxy-2H-pyran-2-one in which the hydrogen at position 6 is replaced by a 2-hydroxytridecyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C18H30O4
Net Charge 0
Average Mass 310.42840
Monoisotopic Mass 310.21441
InChI InChI=1S/C18H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(19)12-17-13-16(20)14-18(21)22-17/h13-15,19-20H,2-12H2,1H3
InChIKey ICCRUNGFVSMBMK-UHFFFAOYSA-N
SMILES CCCCCCCCCCCC(O)Cc1cc(O)cc(=O)o1
ChEBI Ontology
Outgoing 4-hydroxy-6-(2-hydroxytridecyl)-pyran-2-one (CHEBI:85474) is a 6-alkyl-4-hydroxy-2H-pyran-2-one (CHEBI:85514)
4-hydroxy-6-(2-hydroxytridecyl)-pyran-2-one (CHEBI:85474) is a secondary alcohol (CHEBI:35681)
IUPAC Name
4-hydroxy-6-(2-hydroxytridecyl)-2H-pyran-2-one
Synonyms Sources
3-hydroxytetradecanoyl triketide pyrone SUBMITTER
4-hydroxy-6-(2-hydroxytridecyl)-pyran-2-one UniProt
Registry Number Type Source
10190778 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
15984864 PubMed citation SUBMITTER
Last Modified
22 April 2015