floctafenine

chemical compound

Wikidata entity: Q5459971

C₂₀H₁₇F₃N₂O₄ (P274)


Quantities

P4250defined daily dose1
P2067mass406.114

P233 canonical SMILES String C1=CC=C(C(=C1)C(=O)OCC(CO)O)NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F ???
P366 has use ... Q12140 (medication) medication
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P279 subclass of ... Q11173 (chemical compound) chemical compound
P2868 subject has role ... Q188724 (non-steroidal anti-inflammatory drug) non-steroidal anti-inflammatory drug
External Ids
P267ATC codeN02BG04
P231CAS Registry Number23779-99-9
P683ChEBI ID31612
P592ChEMBL IDCHEMBL2105075
P661ChemSpider ID3243
P661ChemSpider ID21235260
P715DrugBank IDDB08976
P11198DrugCentral ID1178
P8494DSSTOX compound identifierDTXCID9031484
P3117DSSTox substance IDDTXSID8057695
P232EC number245-881-4
P2566ECHA Substance Infocard ID100.041.696
P646Freebase ID/m/0h_c5bg
P2057Human Metabolome Database IDHMDB0252310
P234InChIInChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)
P235InChIKeyAPQPGQGAWABJLN-UHFFFAOYSA-N
P6689MassBank accession IDMSBNK-Waters-WA001468
P6689MassBank accession IDMSBNK-Waters-WA001469
P6689MassBank accession IDMSBNK-Waters-WA001470
P6689MassBank accession IDMSBNK-Waters-WA001471
P6689MassBank accession IDMSBNK-Waters-WA001472
P6689MassBank accession IDMSBNK-Waters-WA001473
P486MeSH descriptor IDC084600
P6366Microsoft Academic ID (discontinued)2781283791
P11199Probes And Drugs IDPD009426
P662PubChem CID3360
P3345RxNorm CUI4444
P2877SureChEMBL ID26841
P11089UniChem compound ID1074601
P652UNIIO04HVX6A9Q

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