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CHEBI:174109 - (R)-Bitalin A

ChEBI IDCHEBI:174109
ChEBI Name(R)-Bitalin A
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SubmitterMetaboLights
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FormulaC13H14O3
Net Charge0
Average Mass218.252
Monoisotopic Mass218.09429
SMILESC=C(CO)C1Cc2cc(C(C)=O)ccc2O1
InChIInChI=1S/C13H14O3/c1-8(7-14)13-6-11-5-10(9(2)15)3-4-12(11)16-13/h3-5,13-14H,1,6-7H2,2H3
InChIKeyJRWKMIYLVXKKAN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(R)-Bitalin A (CHEBI:174109) is a acetophenones (CHEBI:22187)
IUPAC Name 
1-[2-(3-hydroxyprop-1-en-2-yl)-2,3-dihydro-1-benzouran-5-yl]ethanone
Manual XrefsDatabases
22370124ChemSpider
HMDB0040358HMDB