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CHEBI:177454 - Desfesoterodine

ChEBI IDCHEBI:177454
ChEBI NameDesfesoterodine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H31NO2
Net Charge0
Average Mass341.495
Monoisotopic Mass341.23548
SMILESCC(C)N(CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C
InChIInChI=1S/C22H31NO2/c1-16(2)23(17(3)4)13-12-20(19-8-6-5-7-9-19)21-14-18(15-24)10-11-22(21)25/h5-11,14,16-17,20,24-25H,12-13,15H2,1-4H3/t20-/m1/s1
InChIKeyDUXZAXCGJSBGDW-HXUWFJFHSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Desfesoterodine (CHEBI:177454) is a diarylmethane (CHEBI:51614)
IUPAC Name 
2-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-(hydroxymethyl)phenol
Manual XrefsDatabases
DB15578DrugBank
7995131ChemSpider
D10853KEGG DRUG
HMDB0013973HMDB
Registry NumbersSources
CAS:207679-81-0ChemIDplus