CHEBI:230510 - 4-methylnorajmaline

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 4-methylnorajmaline
ChEBI ID CHEBI:230510
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C20H27N2O2
Net Charge +1
Average Mass 327.447
Monoisotopic Mass 327.20670
InChI InChI=1S/C20H27N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21-17)9-15(16(11)18(20)23)22(14,2)19(10)24/h4-7,10-11,14-19,21,23-24H,3,8-9H2,1-2H3/q+1/t10-,11-,14-,15-,16?,17-,18+,19+,20+,22?/m0/s1
InChIKey JZAZLBSWQUUXFV-KPWAWLCZSA-N
SMILES N1[C@@]2([C@@]3(C4=C1C=CC=C4)[C@@H](C5[C@@H]([N+]6([C@]2(C[C@H]5[C@@H]([C@H]6O)CC)[H])C)C3)O)[H]
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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 4-methylnorajmaline (CHEBI:230510) is a hemiaminal (CHEBI:73080)
4-methylnorajmaline (CHEBI:230510) is a monoterpenoid indole alkaloid (CHEBI:65323)
4-methylnorajmaline (CHEBI:230510) is a quaternary ammonium ion (CHEBI:35267)
Synonyms Sources
4-methylnorajmaline UniProt
Nβ-methylnorajmaline SUBMITTER
Manual Xref Database
CPD-21571 MetaCyc accession
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