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CHEBI:209768 - Nodulisporipyrone D

ChEBI IDCHEBI:209768
ChEBI NameNodulisporipyrone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O5
Net Charge0
Average Mass258.314
Monoisotopic Mass258.14672
SMILESCCCCC[C@H](O)[C@@H](O)[C@@H]1CC(OC)=CC(=O)O1
InChIInChI=1S/C13H22O5/c1-3-4-5-6-10(14)13(16)11-7-9(17-2)8-12(15)18-11/h8,10-11,13-14,16H,3-7H2,1-2H3/t10-,11-,13+/m0/s1
InChIKeyOQAKOTWWJUZJNV-GMXVVIOVSA-N
Species of MetaboliteComponentSourceComments
Nodulisporiumspecies 65-12-7-1 (ncbitaxon:1380445) - PubMed (25981163)
ChEBI Ontology
Outgoing Relation(s)
Nodulisporipyrone D (CHEBI:209768) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(2S)-2-[(1R,2S)-1,2-dihydroxyheptyl]-4-methoxy-2,3-dihydropyran-6-one
Manual XrefsDatabases
78437945ChemSpider