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CHEBI:36381 - (2S,3S,11bS)-benzquinamide

Default Structure
ChEBI IDCHEBI:36381
ChEBI Name(2S,3S,11bS)-benzquinamide
Stars
ASCII Name(2S,3S,11bS)-benzquinamide
Last Modified20 August 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC22H32N2O5
Net Charge0
Average Mass404.507
Monoisotopic Mass404.23112
SMILES[H][C@@]12C[C@H](OC(C)=O)[C@@H](C(=O)N(CC)CC)CN1CCc1cc(OC)c(OC)cc12
InChIInChI=1S/C22H32N2O5/c1-6-23(7-2)22(26)17-13-24-9-8-15-10-20(27-4)21(28-5)11-16(15)18(24)12-19(17)29-14(3)25/h10-11,17-19H,6-9,12-13H2,1-5H3/t17-,18-,19-/m0/s1
InChIKeyJSZILQVIPPROJI-FHWLQOOXSA-N
Roles Classification
Biological Roles:
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
H1-receptor antagonist  H1-receptor antagonists are the drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine.
Applications:
antiemetic  A drug used to prevent nausea or vomiting. An antiemetic may act by a wide range of mechanisms: it might affect the medullary control centres (the vomiting centre and the chemoreceptive trigger zone) or affect the peripheral receptors.
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
sedative  A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
H1-receptor antagonist  H1-receptor antagonists are the drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine.
antipsychotic agent  Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect.
ChEBI Ontology
Outgoing Relation(s)
(2S,3S,11bS)-benzquinamide (CHEBI:36381) is a benzquinamide (CHEBI:27662)
IUPAC Name 
(2S,3S,11bS)-3-(diethylcarbamoyl)-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-yl acetate
Registry NumbersSources
Beilstein:502386Beilstein