CHEBI:2503 - Affinisine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Affinisine
ChEBI ID CHEBI:2503
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H24N2O
Net Charge 0
Average Mass 308.418
Monoisotopic Mass 308.18886
InChI InChI=1S/C20H24N2O/c1-3-12-10-22-18-9-15-13-6-4-5-7-17(13)21(2)20(15)19(22)8-14(12)16(18)11-23/h3-7,14,16,18-19,23H,8-11H2,1-2H3/b12-3-/t14-,16?,18-,19-/m0/s1
InChIKey UVWQYWHKTZABSO-FZGOZLGSSA-N
SMILES C\C=C1\CN2[C@H]3Cc4c([C@@H]2C[C@@H]1C3CO)n(C)c1ccccc41
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Affinisine (CHEBI:2503) is a indole alkaloid (CHEBI:38958)
Synonym Source
Affinisine KEGG COMPOUND
Manual Xrefs Databases
C00001676 KNApSAcK
C09022 KEGG COMPOUND
View more database links
Registry Number Type Source
2912-11-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014