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CHEBI:4003 - Cycloguanil pamoate

Default Structure
ChEBI IDCHEBI:4003
ChEBI NameCycloguanil pamoate
Stars
Last Modified28 July 2014
DownloadsMolfile
Formula2C11H14ClN5.C23H16O6
Net Charge0
Average Mass891.817
Monoisotopic Mass890.28223
SMILESCC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1.CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1.O=C(O)c1cc2ccccc2c(Cc2c(O)c(C(=O)O)cc3ccccc23)c1O
InChIInChI=1S/C23H16O6.2C11H14ClN5/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;2*1-11(2)16-9(13)15-10(14)17(11)8-5-3-7(12)4-6-8/h1-10,24-25H,11H2,(H,26,27)(H,28,29);2*3-6H,1-2H3,(H4,13,14,15,16)
InChIKeyLUNRMKZYOGNOTR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Cycloguanil pamoate (CHEBI:4003) is a polymer (CHEBI:60027)
Synonym  Source
Cycloguanil pamoateKEGG COMPOUND
Manual XrefsDatabases
C11724KEGG COMPOUND
D02387KEGG DRUG
Registry NumbersSources
CAS:609-78-9KEGG COMPOUND