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CHEBI:8688 - Pyrvinium pamoate

ChEBI IDCHEBI:8688
ChEBI NamePyrvinium pamoate
Stars
Last Modified23 April 2020
DownloadsMolfile
FormulaC23H14O6.2C26H28N3
Net Charge0
Average Mass1151.421
Monoisotopic Mass1150.53568
SMILESCc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1.Cc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1.O=C([O-])c1cc2ccccc2c(Cc2c(O)c(C(=O)[O-])cc3ccccc23)c1O
InChIInChI=1S/2C26H28N3.C23H16O6/c2*1-19-17-21(20(2)29(19)24-9-7-6-8-10-24)11-13-23-14-12-22-18-25(27(3)4)15-16-26(22)28(23)5;24-20-16(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/h2*6-18H,1-5H3;1-10,24-25H,11H2,(H,26,27)(H,28,29)/q2*+1;/p-2
InChIKeyOOPDAHSJBRZRPH-UHFFFAOYSA-L
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
ChEBI Ontology
Outgoing Relation(s)
Pyrvinium pamoate (CHEBI:8688) has role anticoronaviral agent (CHEBI:149553)
Pyrvinium pamoate (CHEBI:8688) is a naphthoic acid (CHEBI:25483)
Synonyms  Source
Pyrvinium pamoateKEGG COMPOUND
PovanKEGG COMPOUND
Manual XrefsDatabases
D00489KEGG DRUG
Registry NumbersSources
CAS:3546-41-6KEGG COMPOUND