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CHEBI:5059 - ficine

ChEBI IDCHEBI:5059
ChEBI Nameficine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H19NO4
Net Charge0
Average Mass337.375
Monoisotopic Mass337.13141
SMILESCN1CCCC1c1c(O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
InChIInChI=1S/C20H19NO4/c1-21-9-5-8-13(21)18-14(22)10-15(23)19-16(24)11-17(25-20(18)19)12-6-3-2-4-7-12/h2-4,6-7,10-11,13,22-23H,5,8-9H2,1H3
InChIKeyYTRPTVLTUWVLKO-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
ficine (CHEBI:5059) is a N-alkylpyrrolidine (CHEBI:46775)
ficine (CHEBI:5059) is a dihydroxyflavone (CHEBI:38686)
Synonyms  Source
FicineKEGG COMPOUND
4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-(1-methyl-2-pyrrolidinyl)-2-phenyl-, (-)-KEGG COMPOUND
Manual XrefsDatabases
C10594KEGG COMPOUND
C00002339KNApSAcK
Registry NumbersSources
CAS:2520-36-7KEGG COMPOUND