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CHEBI:221436 - Clearanol A

ChEBI IDCHEBI:221436
ChEBI NameClearanol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O5
Net Charge0
Average Mass226.228
Monoisotopic Mass226.08412
SMILESC=C(c1oc(=O)cc(OC)c1CO)[C@@H](C)O
InChIInChI=1S/C11H14O5/c1-6(7(2)13)11-8(5-12)9(15-3)4-10(14)16-11/h4,7,12-13H,1,5H2,2-3H3/t7-/m1/s1
InChIKeyWCSOSFHNBSGWPA-SSDOTTSWSA-N
Species of MetaboliteComponentSourceComments
Entrophosporaspecies (ncbitaxon:1920922) - PubMed (22844162)
ChEBI Ontology
Outgoing Relation(s)
Clearanol A (CHEBI:221436) is a pyranone (CHEBI:37963)
IUPAC Name 
6-[(3R)-3-hydroxybut-1-en-2-yl]-5-(hydroxymethyl)-4-methoxypyran-2-one
Manual XrefsDatabases
28533947ChemSpider