CHEBI:6874 - Methylergonovine Maleate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Methylergonovine Maleate
ChEBI ID CHEBI:6874
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C20H25N3O2
C20H25N3O2.C4H4O4
C24H29N3O6
Net Charge 0
Average Mass 455.504
Monoisotopic Mass 455.20564
InChI InChI=1S/C20H25N3O2.C4H4O4/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13;5-3(6)1-2-4(7)8/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-,14+,18-;/m1./s1
InChIKey NOFOWWRHEPHDCY-DAUURJMHSA-N
SMILES C1=2C=3C=4[C@](N(C[C@@H](C4)C(N[C@@H](CC)CO)=O)C)(CC1=CNC2C=CC3)[H].C(/C=C\C(O)=O)(O)=O
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 )
Application(s): geroprotector
Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Methylergonovine Maleate (CHEBI:6874) has role geroprotector (CHEBI:176497)
Methylergonovine Maleate (CHEBI:6874) is a ergoline alkaloid (CHEBI:60529)
Synonyms Sources
Methylergometrine maleate KEGG COMPOUND
Methylergonovine maleate KEGG COMPOUND
Manual Xrefs Databases
C07800 KEGG COMPOUND
D00680 KEGG DRUG
View more database links
Registry Numbers Types Sources
113-42-8 CAS Registry Number KEGG COMPOUND
57432-61-8 CAS Registry Number KEGG COMPOUND
Citation Waiting for Citations Type Source
24134630 PubMed citation Europe PMC
Last Modified
26 October 2021