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CHEBI:31680 - hydroxyzine pamoate

ChEBI IDCHEBI:31680
ChEBI Namehydroxyzine pamoate
Stars
Last Modified25 February 2016
DownloadsMolfile
FormulaC21H29ClN2O2.C23H14O6
Net Charge0
Average Mass763.287
Monoisotopic Mass762.27079
SMILESO=C([O-])c1cc2ccccc2c(Cc2c(O)c(C(=O)[O-])cc3ccccc23)c1O.OCCOCC[NH+]1CC[NH+](C(c2ccccc2)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C23H16O6.C21H27ClN2O2/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-10,24-25H,11H2,(H,26,27)(H,28,29);1-9,21,25H,10-17H2
InChIKeyASDOKGIIKXGMNB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
hydroxyzine pamoate (CHEBI:31680) has part hydroxyzine (CHEBI:5818)
hydroxyzine pamoate (CHEBI:31680) has part pamoate(2−) (CHEBI:50187)
hydroxyzine pamoate (CHEBI:31680) is a piperazinium salt (CHEBI:46849)
IUPAC Name 
1-[(4-chlorophenyl)(phenyl)methyl]-4-[2-(2-hydroxyethoxy)ethyl]piperazinediium 4,4'-methylenebis(3-hydroxynaphthalene-2-carboxylate)
Synonym  Source
Hydroxyzyne pamoateChemIDplus
Brand Name  Source
VistarilChemIDplus
Manual XrefsDatabases
D01096KEGG DRUG
DB00557DrugBank
LSM-15602LINCS
Registry NumbersSources
CAS:10246-75-0ChemIDplus