WB-4101

chemical compound

Wikidata entity: Q21098843

C₁₉H₂₃NO₅ (P274)




Quantities

P2067mass345.157623

P233 canonical SMILES String COC1=C(C(=CC=C1)OC)OCCNCC2COC3=CC=CC=C3O2 ???
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
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
P129 physically interacts with ... Q4734892 (Adrenoceptor alpha 2A) Adrenoceptor alpha 2A
P129 physically interacts with ... Q21141045 (Adrenoceptor alpha 2B) Adrenoceptor alpha 2B
P279 subclass of ... Q11173 (chemical compound) chemical compound
P2868 subject has role ... Q1927838 (alpha blocker) alpha blocker

External Ids
P231CAS Registry Number613-67-2
P683ChEBI ID64098
P592ChEMBL IDCHEMBL25554
P661ChemSpider ID5483
P8494DSSTOX compound identifierDTXCID9023885
P3117DSSTox substance IDDTXSID1043885
P646Freebase ID/m/012dvjm2
P595Guide to Pharmacology Ligand ID499
P2057Human Metabolome Database IDHMDB0242457
P234InChIInChI=1S/C19H23NO5/c1-21-17-8-5-9-18(22-2)19(17)23-11-10-20-12-14-13-24-15-6-3-4-7-16(15)25-14/h3-9,14,20H,10-13H2,1-2H3
P235InChIKeyGYSZUJHYXCZAKI-UHFFFAOYSA-N
P486MeSH descriptor IDC010654
P11199Probes And Drugs IDPD050991
P662PubChem CID5685
P1579Reaxys registry number4206776
P2877SureChEMBL ID800982
P11089UniChem compound ID344871
P652UNIIE9H51OIT2B

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