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CHEBI:750399 - canagliflozin anhydrous

Default Structure
ChEBI IDCHEBI:750399
ChEBI Namecanagliflozin anhydrous
Stars
Last Modified29 June 2026
Submitterchembl-etl
DownloadsMolfile
FormulaC24H25FO5S
Net Charge0
Average Mass444.524
Monoisotopic Mass444.14067
SMILESCc1ccc([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc(-c2ccc(F)cc2)s1
InChIInChI=1S/C24H25FO5S/c1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14/h2-10,19,21-24,26-29H,11-12H2,1H3/t19-,21-,22+,23-,24+/m1/s1
InChIKeyXTNGUQKDFGDXSJ-ZXGKGEBGSA-N
ChEBI Ontology
Outgoing Relation(s)
canagliflozin anhydrous (CHEBI:750399) is a organofluorine compound (CHEBI:37143)
Citations