CHEBI:77618 - norajmaline(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name norajmaline(1+)
ChEBI ID CHEBI:77618
Definition An organic cation obtained by protonation of the tertiary amino group of norajmaline; major structure at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C19H25N2O2
Net Charge +1
Average Mass 313.41350
Monoisotopic Mass 313.19105
InChI InChI=1S/C19H24N2O2/c1-2-9-10-7-13-16-19(11-5-3-4-6-12(11)20-16)8-14(15(10)17(19)22)21(13)18(9)23/h3-6,9-10,13-18,20,22-23H,2,7-8H2,1H3/p+1/t9-,10-,13-,14?,15-,16-,17+,18+,19+/m0/s1
InChIKey HIOAYNMZFIHQNS-WGSNPMNHSA-O
SMILES CC[C@@H]1[C@@H](O)[NH+]2C3C[C@]45[C@H](O)[C@@H]3[C@H]1C[C@H]2[C@@H]4Nc1ccccc51
ChEBI Ontology
Outgoing norajmaline(1+) (CHEBI:77618) is a ammonium ion derivative (CHEBI:35274)
norajmaline(1+) (CHEBI:77618) is a organic cation (CHEBI:25697)
norajmaline(1+) (CHEBI:77618) is conjugate acid of norajmaline (CHEBI:7621)
Incoming norajmaline (CHEBI:7621) is conjugate base of norajmaline(1+) (CHEBI:77618)
IUPAC Name
(2β,7β,17R,20β,21α)-17,21-dihydroxy-2,7,19,20-tetrahydro-7,17-cyclosarpagan-4-ium
Synonym Source
norajmaline UniProt
Last Modified
17 April 2014