Terminology Service for NFDI4Health
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propamidine isethionate

Go to external page http://purl.obolibrary.org/obo/CHEBI_87175

A guanidinium salt obtained by combining propamidine with two molar equivalents of isethionic acid. Used for the treatment of minor eye or eyelid infections, such as conjunctivitis and blepharitis.

Term info

Label

propamidine isethionate

Synonyms
  • 2-hydroxyethane-1-sulfonic acid--4,4'-[propane-1,3-diylbis(oxy)]di(benzene-1-carboximidamide) (2/1)
  • Propamidine isethionate
  • [propane-1,3-diylbis(oxy-4,1-phenylene)]bis(iminomethanaminium) bis(2-hydroxyethane-1-sulfonate)
database cross reference
Subsets

3_STAR

BRAND NAME
Golden eye drops [ KEGG_DRUG ]

IUPAC NAME
2-hydroxyethane-1-sulfonic acid--4,4'-[propane-1,3-diylbis(oxy)]di(benzene-1-carboximidamide) (2/1) [ IUPAC ]

IUPAC NAME
[propane-1,3-diylbis(oxy-4,1-phenylene)]bis(iminomethanaminium) bis(2-hydroxyethane-1-sulfonate) [ IUPAC ]

charge

0

formula

C21H32N4O10S2

has obo namespace

chebi_ontology

has related synonym

M&B 782, Propamidine diisethionate, M + B 782, Golden eye drops

id

CHEBI:87175

inchi

InChI=1S/C17H20N4O2.2C2H6O4S/c18-16(19)12-2-6-14(7-3-12)22-10-1-11-23-15-8-4-13(5-9-15)17(20)21;2*3-1-2-7(4,5)6/h2-9H,1,10-11H2,(H3,18,19)(H3,20,21);2*3H,1-2H2,(H,4,5,6)

inchikey

WSOSYBUSMXEYDO-UHFFFAOYSA-N

mass

564.63000

monoisotopicmass

564.15599

smiles

OCCS(O)(=O)=O.OCCS(O)(=O)=O.NC(=N)c1ccc(OCCCOc2ccc(cc2)C(N)=N)cc1