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CHEBI:760768 - O-demethyl apixaban sulfate

Default Structure
ChEBI IDCHEBI:760768
ChEBI NameO-demethyl apixaban sulfate
Stars
ASCII NameO-demethyl apixaban sulfate
DefinitionIt is a metabolite of apixaban an inhibitor of coagulation factor Xa with anticoagulant activity.
Last Modified21 August 2026
SubmitterMatthias König
DownloadsMolfile
FormulaC24H23N5O7S
Net Charge0
Average Mass525.543
Monoisotopic Mass525.13182
SMILESNC(=O)c1nn(-c2ccc(OS(=O)(=O)O)cc2)c2c1CCN(c1ccc(N3CCCCC3=O)cc1)C2=O
InChIInChI=1S/C24H23N5O7S/c25-23(31)21-19-12-14-28(16-6-4-15(5-7-16)27-13-2-1-3-20(27)30)24(32)22(19)29(26-21)17-8-10-18(11-9-17)36-37(33,34)35/h4-11H,1-3,12-14H2,(H2,25,31)(H,33,34,35)
InChIKeyHRIFVOGTDGFZKP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000118) PubMed (18832478)
Roles Classification
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
O-demethyl apixaban sulfate (CHEBI:760768) has role drug metabolite (CHEBI:49103)
O-demethyl apixaban sulfate (CHEBI:760768) has role human xenobiotic metabolite (CHEBI:76967)
O-demethyl apixaban sulfate (CHEBI:760768) is a aryl sulfate (CHEBI:37919)
O-demethyl apixaban sulfate (CHEBI:760768) is a piperidones (CHEBI:48589)
O-demethyl apixaban sulfate (CHEBI:760768) is a primary carboxamide (CHEBI:140324)
O-demethyl apixaban sulfate (CHEBI:760768) is a pyrazolopyridine (CHEBI:46699)
IUPAC Name 
4-{3-carbamoyl-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-1-yl}phenyl hydrogen sulfate
Synonyms  Source
apixaban impurity 242ChEBI
apixaban (M1)PubChem Compound
apixaban (metabolite M1)PubChem Compound
O-desmethyl apixaban sulfateChEBI
O-desmethylapixaban-sulfate (M1)PubChem Compound
Manual XrefsDatabases
HMDB0259525HMDB
Registry NumbersSources
CAS:1118765-14-2ChEBI
Citations