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CHEBI:205798 - 6-(2′S-hydroxy-5′E-ene-1′-heptyl)-4-hydroxy-3-methyl-2H-pyran-2-one

ChEBI IDCHEBI:205798
ChEBI Name6-(2′S-hydroxy-5′E-ene-1′-heptyl)-4-hydroxy-3-methyl-2H-pyran-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H18O4
Net Charge0
Average Mass238.283
Monoisotopic Mass238.12051
SMILESC/C=C/CC[C@H](O)Cc1cc(O)c(C)c(=O)o1
InChIInChI=1S/C13H18O4/c1-3-4-5-6-10(14)7-11-8-12(15)9(2)13(16)17-11/h3-4,8,10,14-15H,5-7H2,1-2H3/b4-3+/t10-/m0/s1
InChIKeyRYNJIMOMAPRLSD-FSIBCCDJSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (30129376)
ChEBI Ontology
Outgoing Relation(s)
6-(2′S-hydroxy-5′E-ene-1′-heptyl)-4-hydroxy-3-methyl-2H-pyran-2-one (CHEBI:205798) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
4-hydroxy-6-[(E,2S)-2-hydroxyhept-5-enyl]-3-methylpyran-2-one