CHEBI:174999 - 4R-Hydroxy solifenacin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 4R-Hydroxy solifenacin
ChEBI ID CHEBI:174999
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C23H26N2O3
Net Charge 0
Average Mass 378.472
Monoisotopic Mass 378.19434
InChI InChI=1S/C23H26N2O3/c26-20-14-25(23(27)28-21-15-24-12-10-16(21)11-13-24)22(17-6-2-1-3-7-17)19-9-5-4-8-18(19)20/h1-9,16,20-22,26H,10-15H2/t20-,21?,22-/m0/s1
InChIKey LRNNBJBAUXSVMH-NHNZYLEHSA-N
SMILES O(C1C2CCN(C1)CC2)C(=O)N3[C@H](C=4C([C@@H](O)C3)=CC=CC4)C5=CC=CC=C5
ChEBI Ontology
Outgoing 4R-Hydroxy solifenacin (CHEBI:174999) is a isoquinolines (CHEBI:24922)
IUPAC Name
1-azabicyclo[2.2.2]octan-3-yl (1S,4R)-4-hydroxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
Manual Xrefs Databases
35031852 ChemSpider
HMDB0061127 HMDB
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