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CHEBI:52767 - rhodamine red-X

ChEBI IDCHEBI:52767
ChEBI Namerhodamine red-X
Stars
DefinitionA sulfonated xanthene dye of absorption wavelength 573 nm and emission wavelength 591 nm.
Last Modified20 July 2009
SubmitterSteve
DownloadsMolfile
FormulaC33H41N3O8S2
Net Charge0
Average Mass671.838
Monoisotopic Mass671.23351
SMILESCCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)NCCCCCC(=O)O)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1
InChIInChI=1S/C33H41N3O8S2/c1-5-35(6-2)23-13-16-26-29(20-23)44-30-21-24(36(7-3)8-4)14-17-27(30)33(26)28-18-15-25(22-31(28)46(41,42)43)45(39,40)34-19-11-9-10-12-32(37)38/h13-18,20-22,34H,5-12,19H2,1-4H3,(H-,37,38,41,42,43)
InChIKeyXLXOKMFKGASILN-UHFFFAOYSA-N
Roles Classification
Applications:
fluorochrome  A fluorescent dye used to stain biological specimens.
dye 
ChEBI Ontology
Outgoing Relation(s)
rhodamine red-X (CHEBI:52767) has role fluorochrome (CHEBI:51217)
rhodamine red-X (CHEBI:52767) is a xanthene dye (CHEBI:37929)
IUPAC Name 
5-[(5-carboxypentyl)sulfamoyl]-2-[6-(diethylamino)-3-(diethyliminio)-3H-xanthen-9-yl]benzenesulfonate
Registry NumbersSources
Beilstein:9829276Beilstein