CHEBI:9108 - seneciphylline

ChEBI IDCHEBI:9108
ChEBI Nameseneciphylline
Stars
Last Modified8 February 2018
DownloadsMolfile
FormulaC18H23NO5
Net Charge0
Average Mass333.384
Monoisotopic Mass333.15762
SMILES[H][C@]12C3=CCN1CC[C@H]2OC(=O)/C(=C\C)CC(=C)[C@@](C)(O)C(=O)OC3
InChIInChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18-/m1/s1
InChIKeyFCEVNJIUIMLVML-QPSVUOIXSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
seneciphylline (CHEBI:9108) is a pyrrolizine alkaloid (CHEBI:38521)
Incoming Relation(s)
acetylseneciphylline (CHEBI:136430) has functional parent seneciphylline (CHEBI:9108)
acetylseneciphylline N-oxide (CHEBI:136449) has functional parent seneciphylline (CHEBI:9108)
jacozine (CHEBI:136458) has functional parent seneciphylline (CHEBI:9108)
seneciphylline N-oxide (CHEBI:136404) has functional parent seneciphylline (CHEBI:9108)
Synonym  Source
SeneciphyllineKEGG COMPOUND
Manual XrefsDatabases
C10391KEGG COMPOUND
C00002117KNApSAcK
Registry NumbersSources
CAS:480-81-9KEGG COMPOUND