EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:32059 - Promethazine teoclate

ChEBI IDCHEBI:32059
ChEBI NamePromethazine teoclate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC17H20N2S.C7H7ClN4O2
Net Charge0
Average Mass499.040
Monoisotopic Mass498.16047
SMILESCC(CN1c2ccccc2Sc2ccccc21)N(C)C.Cn1c(=O)c2nc(Cl)nc2n(C)c1=O
InChIInChI=1S/C17H20N2S.C7H7ClN4O2/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19;1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h4-11,13H,12H2,1-3H3;1-2H3,(H,9,10)
InChIKeyYCXARMXCESBEDS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Promethazine teoclate (CHEBI:32059) is a phenothiazines (CHEBI:38093)
Synonyms  Source
Avomine (TN)KEGG COMPOUND
Promethazine teoclateKEGG COMPOUND
Manual XrefsDatabases
D01242KEGG DRUG
Registry NumbersSources
CAS:17693-51-5KEGG COMPOUND