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CHEBI:218050 - Vertilecanin A Methy ester

ChEBI IDCHEBI:218050
ChEBI NameVertilecanin A Methy ester
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H13NO3
Net Charge0
Average Mass243.262
Monoisotopic Mass243.08954
SMILESCOC(=O)c1ccc([C@H](O)c2ccccc2)cn1
InChIInChI=1S/C14H13NO3/c1-18-14(17)12-8-7-11(9-15-12)13(16)10-5-3-2-4-6-10/h2-9,13,16H,1H3/t13-/m1/s1
InChIKeyOYECEMYHIYCSDK-CYBMUJFWSA-N
Species of MetaboliteComponentSourceComments
Akanthomyces lecanii (ncbitaxon:2714763) - DOI (10.1021/np000094q)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Vertilecanin A Methy ester (CHEBI:218050) is a pyrimidinecarboxylic acid (CHEBI:78574)
IUPAC Name 
methyl 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylate
Manual XrefsDatabases
8833203ChemSpider