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CHEBI:63110 - (S,S)-formoterol(1+)

ChEBI IDCHEBI:63110
ChEBI Name(S,S)-formoterol(1+)
Stars
ASCII Name(S,S)-formoterol(1+)
DefinitionAn ammonium ion resulting from the protonation of the non-formylated amino group of (S,S)-formoterol.
Last Modified25 October 2011
SubmitterGareth Owen
DownloadsMolfile
FormulaC19H25N2O4
Net Charge+1
Average Mass345.419
Monoisotopic Mass345.18088
SMILES[H]C(=O)Nc1cc([C@H](O)C[NH2+][C@@H](C)Cc2ccc(OC)cc2)ccc1O
InChIInChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)/p+1/t13-,19+/m0/s1
InChIKeyBPZSYCZIITTYBL-ORAYPTAESA-O
ChEBI Ontology
Outgoing Relation(s)
(S,S)-formoterol(1+) (CHEBI:63110) is a ammonium ion derivative (CHEBI:35274)
(S,S)-formoterol(1+) (CHEBI:63110) is a organic cation (CHEBI:25697)
(S,S)-formoterol(1+) (CHEBI:63110) is conjugate acid of (S,S)-formoterol (CHEBI:63081)
(S,S)-formoterol(1+) (CHEBI:63110) is enantiomer of arformoterol(1+) (CHEBI:63107)
Incoming Relation(s)
(S,S)-formoterol fumarate (CHEBI:63109) has part (S,S)-formoterol(1+) (CHEBI:63110)
formoterol(1+) (CHEBI:63111) has part (S,S)-formoterol(1+) (CHEBI:63110)
(S,S)-formoterol (CHEBI:63081) is conjugate base of (S,S)-formoterol(1+) (CHEBI:63110)
arformoterol(1+) (CHEBI:63107) is enantiomer of (S,S)-formoterol(1+) (CHEBI:63110)
IUPAC Name 
(2S)-N-{(2S)-2-[3-(formylamino)-4-hydroxyphenyl]-2-hydroxyethyl}-1-(4-methoxyphenyl)propan-2-aminium
Synonym  Source
(+)-formoterol(1+)ChEBI