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CHEBI:52274 - sulforhodamine 101

ChEBI IDCHEBI:52274
ChEBI Namesulforhodamine 101
Stars
Last Modified1 April 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC31H30N2O7S2
Net Charge0
Average Mass606.722
Monoisotopic Mass606.14944
SMILESO=S(=O)([O-])c1ccc(-c2c3cc4c5c(c3[o+]c3c6c7c(cc23)CCCN7CCC6)CCCN5CCC4)c(S(=O)(=O)O)c1
InChIInChI=1S/C31H30N2O7S2/c34-41(35,36)20-9-10-21(26(17-20)42(37,38)39)27-24-15-18-5-1-11-32-13-3-7-22(28(18)32)30(24)40-31-23-8-4-14-33-12-2-6-19(29(23)33)16-25(27)31/h9-10,15-17H,1-8,11-14H2,(H-,34,35,36,37,38,39)
InChIKeyCOIVODZMVVUETJ-UHFFFAOYSA-N
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
sulforhodamine 101 (CHEBI:52274) has role fluorochrome (CHEBI:51217)
sulforhodamine 101 (CHEBI:52274) is a organic heteroheptacyclic compound (CHEBI:52157)
IUPAC Name 
4-(2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-pyrido[3,2,1-ij]quinolizino[1',9':6,7,8]chromeno[2,3-f]quinolin-18-ium-9-yl)-3-sulfobenzenesulfonate
Registry NumbersSources
CAS:60311-02-6ChemIDplus