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CHEBI:216317 - Phlebopine C

ChEBI IDCHEBI:216317
ChEBI NamePhlebopine C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H17NO4
Net Charge0
Average Mass239.271
Monoisotopic Mass239.11576
SMILESCCOC(=O)[C@@H](C)n1c(C=O)ccc1COC
InChIInChI=1S/C12H17NO4/c1-4-17-12(15)9(2)13-10(7-14)5-6-11(13)8-16-3/h5-7,9H,4,8H2,1-3H3/t9-/m1/s1
InChIKeySXPQRNHKSKIQRX-SECBINFHSA-N
Species of MetaboliteComponentSourceComments
Phlebopus portentosus (ncbitaxon:80661) - PubMed (29772776)
ChEBI Ontology
Outgoing Relation(s)
Phlebopine C (CHEBI:216317) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
ethyl (2R)-2-[2-ormyl-5-(methoxymethyl)pyrrol-1-yl]propanoate