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CHEBI:136001 - itramin tosilate

ChEBI IDCHEBI:136001
ChEBI Nameitramin tosilate
Stars
DefinitionAn organosulfonate salt obtained by combining equimolar amounts of aminoethyl nitrate and 4-toluenesulfonic acid. Used as a vasodilator for the treatment of angina.
Last Modified26 November 2020
DownloadsMolfile
FormulaC2H6N2O3.C7H8O3S
Net Charge0
Average Mass278.286
Monoisotopic Mass278.05726
SMILESCc1ccc(S(=O)(=O)O)cc1.NCCO[N+](=O)[O-]
InChIInChI=1S/C7H8O3S.C2H6N2O3/c1-6-2-4-7(5-3-6)11(8,9)10;3-1-2-7-4(5)6/h2-5H,1H3,(H,8,9,10);1-3H2
InChIKeyHPPBBWMYZVALRK-UHFFFAOYSA-N
Wikipedia
Roles Classification
Application:
vasodilator agent  A drug used to cause dilation of the blood vessels.
ChEBI Ontology
Outgoing Relation(s)
itramin tosilate (CHEBI:136001) has part aminoethyl nitrate (CHEBI:166870)
itramin tosilate (CHEBI:136001) has role vasodilator agent (CHEBI:35620)
itramin tosilate (CHEBI:136001) is a organosulfonate salt (CHEBI:64382)
IUPAC Name 
2-aminoethyl nitrate 4-methylbenzenesulfonate
INNs  Source
itramini tosilasWHO MedNet
tosilato de itraminaWHO MedNet
tosilate d'itramineWHO MedNet
Synonyms  Source
itramin tosylateDrugCentral
itramina tosilatoChEBI
2-aminoethanol nitrate mono-p-toluenesulfonateChEBI
2-nitratoethylaminotoluene-p-sulfonateChEBI
2-aminoethanol nitrate mono(4-methylbenzenesulfonate)ChEBI
4-methylbenzene-1-sulfonic acid—2-aminoethyl nitrateIUPAC
Brand Names  Source
itramin tosilateWHO MedNet
TostraminChemIDplus
TostramChemIDplus
CardisanChemIDplus
NilatilChemIDplus
Manual XrefsDatabases
4583DrugCentral
DBSALT002523DrugBank
D07157KEGG DRUG
Itramin_tosilateWikipedia
24219ChemSpider
Registry NumbersSources
CAS:13445-63-1ChemIDplus
Citations