CHEBI:75738 - (S,S)-tramadol(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (S,S)-tramadol(1+)
ChEBI ID CHEBI:75738
ChEBI ASCII Name (S,S)-tramadol(1+)
Definition An organic cation obtained by protonation of the tertiary amino group of (S,S)-tramadol.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H26NO2
Net Charge +1
Average Mass 264.38310
Monoisotopic Mass 264.19581
InChI InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/p+1/t14-,16+/m0/s1
InChIKey TVYLLZQTGLZFBW-GOEBONIOSA-O
SMILES COc1cccc(c1)[C@]1(O)CCCC[C@H]1C[NH+](C)C
ChEBI Ontology
Outgoing (S,S)-tramadol(1+) (CHEBI:75738) is a ammonium ion derivative (CHEBI:35274)
(S,S)-tramadol(1+) (CHEBI:75738) is a organic cation (CHEBI:25697)
(S,S)-tramadol(1+) (CHEBI:75738) is conjugate acid of (S,S)-tramadol (CHEBI:75731)
(S,S)-tramadol(1+) (CHEBI:75738) is enantiomer of (R,R)-tramadol(1+) (CHEBI:75737)
Incoming (S,S)-tramadol hydrochloride (CHEBI:75734) has part (S,S)-tramadol(1+) (CHEBI:75738)
tramadol(1+) (CHEBI:75736) has part (S,S)-tramadol(1+) (CHEBI:75738)
(S,S)-tramadol (CHEBI:75731) is conjugate base of (S,S)-tramadol(1+) (CHEBI:75738)
(R,R)-tramadol(1+) (CHEBI:75737) is enantiomer of (S,S)-tramadol(1+) (CHEBI:75738)
IUPAC Name
[(1S,2S)-2-hydroxy-2-(3-methoxyphenyl)cyclohexyl]-N,N-dimethylmethanaminium
Synonym Source
(−)-tramadol(1+) ChEBI
Last Modified
26 September 2013