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CHEBI:223581 - Calinaphthalenone A

ChEBI IDCHEBI:223581
ChEBI NameCalinaphthalenone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O4
Net Charge0
Average Mass276.332
Monoisotopic Mass276.13616
SMILESCCCCC[C@@]1(O)C=Cc2c(ccc(O)c2CO)C1=O
InChIInChI=1S/C16H20O4/c1-2-3-4-8-16(20)9-7-11-12(15(16)19)5-6-14(18)13(11)10-17/h5-7,9,17-18,20H,2-4,8,10H2,1H3/t16-/m1/s1
InChIKeyBUNCUEUGMFDOPM-MRXNPFEDSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (32999431)
ChEBI Ontology
Outgoing Relation(s)
Calinaphthalenone A (CHEBI:223581) is a naphthols (CHEBI:25392)
IUPAC Name 
(2R)-2,6-dihydroxy-5-(hydroxymethyl)-2-pentylnaphthalen-1-one