CHEBI:4777 - Elymoclavine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Elymoclavine
ChEBI ID CHEBI:4777
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H18N2O
Net Charge 0
Average Mass 254.328
Monoisotopic Mass 254.14191
InChI InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,13,15,17,19H,6,8-9H2,1H3/t13-,15-/m1/s1
InChIKey DAVNRFCJMIONPO-UKRRQHHQSA-N
SMILES CN1CC(CO)=C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13
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 Elymoclavine (CHEBI:4777) is a alkaloid (CHEBI:22315)
Synonyms Sources
Dihydrolysergol KEGG COMPOUND
Elymoclavine KEGG COMPOUND
Manual Xrefs Databases
C00001717 KNApSAcK
C06068 KEGG COMPOUND
View more database links
Registry Number Type Source
548-43-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014