(1S,2R)-ephedrine(1+) (CHEBI:149673)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	(1S,2R)-ephedrine(1+)

ChEBI ID	CHEBI:149673

ChEBI ASCII Name	(1S,2R)-ephedrine(1+)

Definition	An organic cation obtained by protonation of the secondary amino function of (1S,2R)-ephedrine; major species at pH 7.3.

Stars	This entity has been manually annotated by a third party.

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

Formula

C10H16NO

Net Charge

Average Mass

166.243

Monoisotopic Mass

166.12264

InChI

InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/p+1/t8-,10-/m1/s1

InChIKey

KWGRBVOPPLSCSI-PSASIEDQSA-O

SMILES

[C@H]([C@@H](C)[NH2+]C)(O)C1=CC=CC=C1

ChEBI Ontology
Outgoing	(1S,2R)-ephedrine(1+) (CHEBI:149673) is a ammonium ion derivative (CHEBI:35274) (1S,2R)-ephedrine(1+) (CHEBI:149673) is enantiomer of (−)-ephedrinium (CHEBI:57295)

Incoming	(−)-ephedrinium (CHEBI:57295) is enantiomer of (1S,2R)-ephedrine(1+) (CHEBI:149673)

IUPAC Name

(1S,2R)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium