CHEBI:2986 - Balfourodinium

ChEBI IDCHEBI:2986
ChEBI NameBalfourodinium
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H22NO4
Net Charge+1
Average Mass304.366
Monoisotopic Mass304.15433
SMILESCOc1c2c([n+](C)c3c(OC)cccc13)O[C@@H](C(C)(C)O)C2
InChIInChI=1S/C17H22NO4/c1-17(2,19)13-9-11-15(21-5)10-7-6-8-12(20-4)14(10)18(3)16(11)22-13/h6-8,13,19H,9H2,1-5H3/q+1/t13-/m1/s1
InChIKeyOQZCPLGYHZLFBM-CYBMUJFWSA-N
ChEBI Ontology
Outgoing Relation(s)
Balfourodinium (CHEBI:2986) is a organic heterotricyclic compound (CHEBI:26979)
Balfourodinium (CHEBI:2986) is a organonitrogen heterocyclic compound (CHEBI:38101)
Balfourodinium (CHEBI:2986) is a oxacycle (CHEBI:38104)
Synonym  Source
BalfourodiniumKEGG COMPOUND
Manual XrefsDatabases
C10648KEGG COMPOUND
C00002141KNApSAcK
Registry NumbersSources
CAS:38487-24-0KEGG COMPOUND