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CHEBI:52033 - diIC18(7) dye

ChEBI IDCHEBI:52033
ChEBI NamediIC18(7) dye
Stars
Last Modified24 July 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC63H101N2.I
Net Charge0
Average Mass1013.419
Monoisotopic Mass1012.70095
SMILES[H]C(=C([H])C([H])=C([H])C1=[N+](CCCCCCCCCCCCCCCCCC)c2ccccc2C1(C)C)C([H])=C([H])C([H])=C1N(CCCCCCCCCCCCCCCCCC)c2ccccc2C1(C)C.[I-]
InChIInChI=1S/C63H101N2.HI/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38-46-54-64-58-50-44-42-48-56(58)62(3,4)60(64)52-40-36-35-37-41-53-61-63(5,6)57-49-43-45-51-59(57)65(61)55-47-39-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;/h35-37,40-45,48-53H,7-34,38-39,46-47,54-55H2,1-6H3;1H/q+1;/p-1
InChIKeyJLIOTPLALDYAEH-UHFFFAOYSA-M
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
diIC18(7) dye (CHEBI:52033) has functional parent C7-indocyanine (CHEBI:51901)
diIC18(7) dye (CHEBI:52033) has part diIC18(7)(1+) (CHEBI:52820)
diIC18(7) dye (CHEBI:52033) has role fluorochrome (CHEBI:51217)
diIC18(7) dye (CHEBI:52033) is a organic iodide salt (CHEBI:50356)
IUPAC Name 
2-[7-(3,3-dimethyl-1-octadecyl-1,3-dihydro-2H-indol-2-ylidene)hepta-1,3,5-trien-1-yl]-3,3-dimethyl-1-octadecyl-3H-indolium iodide
Synonyms  Source
DiRChEBI
1,1'-dioctadecyl-3,3,3',3'-tetramethylindotricarbocyanine iodideChEBI