CHEBI:88320 - (S)-nefopam

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ChEBI Name (S)-nefopam
ChEBI ID CHEBI:88320
ChEBI ASCII Name (S)-nefopam
Definition A 5-methyl-1-phenyl-3,4,5,6-tetrahydro-1H-2,5-benzoxazocine that has (S)-configuration (the racemate is a non-opioid analgesic drug).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H19NO
Net Charge 0
Average Mass 253.339
Monoisotopic Mass 253.14666
InChI InChI=1S/C17H19NO/c1-18-11-12-19-17(14-7-3-2-4-8-14)16-10-6-5-9-15(16)13-18/h2-10,17H,11-13H2,1H3/t17-/m0/s1
InChIKey RGPDEAGGEXEMMM-KRWDZBQOSA-N
SMILES C1N(CCO[C@H](C=2C1=CC=CC2)C=3C=CC=CC3)C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (S)-nefopam (CHEBI:88320) is a 5-methyl-1-phenyl-3,4,5,6-tetrahydro-1H-2,5-benzoxazocine (CHEBI:88318)
(S)-nefopam (CHEBI:88320) is conjugate base of (S)-nefopam(1+) (CHEBI:88324)
(S)-nefopam (CHEBI:88320) is enantiomer of (R)-nefopam (CHEBI:88323)
Incoming nefopam (CHEBI:88316) has part (S)-nefopam (CHEBI:88320)
(S)-nefopam(1+) (CHEBI:88324) is conjugate acid of (S)-nefopam (CHEBI:88320)
(R)-nefopam (CHEBI:88323) is enantiomer of (S)-nefopam (CHEBI:88320)
IUPAC Name
(1S)-5-methyl-1-phenyl-3,4,5,6-tetrahydro-1H-2,5-benzoxazocine
Synonym Source
(+)-Nefopam ChemIDplus
Registry Numbers Types Sources
110011-82-0 CAS Registry Number ChemIDplus
7112578 Reaxys Registry Number Reaxys
Last Modified
22 October 2015