CHEBI:52262 - sodium-binding benzofuran isophthalate

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ChEBI Name sodium-binding benzofuran isophthalate
ChEBI ID CHEBI:52262
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C44H42N2O15
Net Charge 0
Average Mass 838.80870
Monoisotopic Mass 838.259
InChI InChI=1S/C44H42N2O15/c1-55-39-21-27-19-37(29-5-3-25(41(47)48)17-31(29)43(51)52)60-35(27)23-33(39)45-7-11-57-12-8-46(10-14-59-16-15-58-13-9-45)34-24-36-28(22-40(34)56-2)20-38(61-36)30-6-4-26(42(49)50)18-32(30)44(53)54/h3-6,17-24H,7-16H2,1-2H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)
InChIKey UGJCNRLBGKEGEH-UHFFFAOYSA-N
SMILES COc1cc2cc(oc2cc1N1CCOCCOCCN(CCOCC1)c1cc2oc(cc2cc1OC)-c1ccc(cc1C(O)=O)C(O)=O)-c1ccc(cc1C(O)=O)C(O)=O
Roles Classification
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sodium-binding benzofuran isophthalate (CHEBI:52262) has role fluorochrome (CHEBI:51217)
sodium-binding benzofuran isophthalate (CHEBI:52262) is a 1-benzofurans (CHEBI:38830)
sodium-binding benzofuran isophthalate (CHEBI:52262) is a phthalate (CHEBI:26092)
IUPAC Name
4,4'-{1,4,10-trioxa-7,13-diazacyclopentadecane-7,13-diylbis[5-(methyloxy)-1-benzofuran-6,2-diyl]}dibenzene-1,3-dicarboxylic acid
Synonyms Sources
SBFI ChemIDplus
Sodium benzofuran isophthalate ChemIDplus
Registry Number Type Source
124549-08-2 CAS Registry Number ChemIDplus
Last Modified
26 March 2009