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CHEBI:206082 - Heterocornol N

ChEBI IDCHEBI:206082
ChEBI NameHeterocornol N
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O4
Net Charge0
Average Mass250.294
Monoisotopic Mass250.12051
SMILESC[C@H](O)C1([C@H](C)O)C=Cc2cccc(O)c2CO1
InChIInChI=1S/C14H18O4/c1-9(15)14(10(2)16)7-6-11-4-3-5-13(17)12(11)8-18-14/h3-7,9-10,15-17H,8H2,1-2H3/t9-,10-/m0/s1
InChIKeyUEEVQJXLTKWXMX-UWVGGRQHSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis (ncbitaxon:37840) - PubMed (31336683)
ChEBI Ontology
Outgoing Relation(s)
Heterocornol N (CHEBI:206082) is a oxacycle (CHEBI:38104)
IUPAC Name 
3,3-bis[(1S)-1-hydroxyethyl]-1H-2-benzoxepin-9-ol