CHEBI:2985 - Balfourodine

ChEBI IDCHEBI:2985
ChEBI NameBalfourodine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC16H19NO4
Net Charge0
Average Mass289.331
Monoisotopic Mass289.13141
SMILESCOc1cccc2c(=O)c3c(n(C)c12)O[C@@H](C(C)(C)O)C3
InChIInChI=1S/C16H19NO4/c1-16(2,19)12-8-10-14(18)9-6-5-7-11(20-4)13(9)17(3)15(10)21-12/h5-7,12,19H,8H2,1-4H3/t12-/m1/s1
InChIKeyVPNKCPHNFBSHAP-GFCCVEGCSA-N
ChEBI Ontology
Outgoing Relation(s)
Balfourodine (CHEBI:2985) is a organic heterotricyclic compound (CHEBI:26979)
Balfourodine (CHEBI:2985) is a organonitrogen heterocyclic compound (CHEBI:38101)
Balfourodine (CHEBI:2985) is a oxacycle (CHEBI:38104)
Synonym  Source
BalfourodineKEGG COMPOUND
Manual XrefsDatabases
C10647KEGG COMPOUND
C00002140KNApSAcK
Registry NumbersSources
CAS:484-61-7KEGG COMPOUND