CHEBI:95178 - 2-hydroxy-2,2-diphenylacetic acid (1-ethyl-1-methyl-3-piperidin-1-iumyl) ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-hydroxy-2,2-diphenylacetic acid (1-ethyl-1-methyl-3-piperidin-1-iumyl) ester
ChEBI ID CHEBI:95178
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H28NO3
Net Charge +1
Average Mass 354.463
Monoisotopic Mass 354.20637
InChI InChI=1S/C22H28NO3/c1-3-23(2)16-10-15-20(17-23)26-21(24)22(25,18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-9,11-14,20,25H,3,10,15-17H2,1-2H3/q+1
InChIKey WPUKUEMZZRVAKZ-UHFFFAOYSA-N
SMILES CC[N+]1(CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C
ChEBI Ontology
Outgoing 2-hydroxy-2,2-diphenylacetic acid (1-ethyl-1-methyl-3-piperidin-1-iumyl) ester (CHEBI:95178) is a diarylmethane (CHEBI:51614)
Synonym Source
pipenzolate bromide DrugCentral
Manual Xrefs Databases
2185 DrugCentral
LSM-6459 LINCS
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Registry Number Type Source
13473-38-6 CAS Registry Number DrugCentral
Last Modified
22 February 2017