spiroxatrine

chemical compound

Wikidata entity: Q6592066

C₂₂H₂₅N₃O₃ (P274)

Quantities

P2067mass379.189592

P233 canonical SMILES String C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4COC5=CC=CC=C5O4 ???
P527 has part(s) ... Q629 (oxygen) oxygen
P527 has part(s) ... Q623 (carbon) carbon
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P129 physically interacts with ... Q4734892 (Adrenoceptor alpha 2A) Adrenoceptor alpha 2A
P129 physically interacts with ... Q21115043 (5-hydroxytryptamine receptor 1A) 5-hydroxytryptamine receptor 1A
P129 physically interacts with ... Q21141045 (Adrenoceptor alpha 2B) Adrenoceptor alpha 2B
P129 physically interacts with ... Q4639596 (5-hydroxytryptamine receptor 2B) 5-hydroxytryptamine receptor 2B
P129 physically interacts with ... Q4734884 (Adrenoceptor alpha 1A) Adrenoceptor alpha 1A
P129 physically interacts with ... Q4734886 (Adrenoceptor alpha 1B) Adrenoceptor alpha 1B
P129 physically interacts with ... Q4734887 (Adrenoceptor alpha 1D) Adrenoceptor alpha 1D
P129 physically interacts with ... Q4734891 (Adrenoceptor alpha 2C) Adrenoceptor alpha 2C
P279 subclass of ... Q11173 (chemical compound) chemical compound
P2868 subject has role ... Q3271533 (dopamine antagonist) dopamine antagonist
External Ids
P231CAS Registry Number1054-88-2
P683ChEBI ID91845
P592ChEMBL IDCHEMBL300555
P661ChemSpider ID5078
P8494DSSTOX compound identifierDTXCID1025198
P3117DSSTox substance IDDTXSID3045198
P646Freebase ID/m/04gk846
P595Guide to Pharmacology Ligand ID53
P234InChIInChI=1S/C22H25N3O3/c26-21-22(25(16-23-21)17-6-2-1-3-7-17)10-12-24(13-11-22)14-18-15-27-19-8-4-5-9-20(19)28-18/h1-9,18H,10-16H2,(H,23,26)
P235InChIKeyJVGBTTIJPBFLTE-UHFFFAOYSA-N
P486MeSH descriptor IDC018387
P6366Microsoft Academic ID (discontinued)2778400260
P11199Probes And Drugs IDPD002604
P662PubChem CID5268
P2877SureChEMBL ID1255303
P11089UniChem compound ID356207
P652UNIIDR0QR50ALL

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