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tetrasulfocyanine(3-)

PropertiesImageOccurences in reactions
MNX_IDMNXM161528Image of MNXM161528
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC32H35N2O12S4
charge-3
mass767.10893
referencechebi:68630
InChIKeyWKWHOLCUESSZIQ-UHFFFAOYSA-K
InChIInChI=1S/C32H38N2O12S4/c1-22(8-6-10-29-31(2,3)25-20-23(49(41,42)43)12-14-27(25)33(29)16-18-47(35,36)37)9-7-11-30-32(4,5)26-21-24(50(44,45)46)13-15-28(26)34(30)17-19-48(38,39)40/h6-15,20-21H,16-19H2,1-5H3,(H3-,35,36,37,38,39,40,41,42,43,44,45,46)/p-3
SMILESCC(/C=C/C=C1/N(CCS(=O)(=O)[O-])c2ccc(S(=O)(=O)[O-])cc2C1(C)C)=C\C=C\C1=[N+](CCS(=O)(=O)[O-])c2ccc(S(=O)(=O)[O-])cc2C1(C)C
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:68630
chebi:68630 		tetrasulfocyanine(3-)
2-{(1E,3E,5E,7E)-7-[3,3-dimethyl-5-sulfonato-1-(2-sulfonatoethyl)-1,3-dihydro-2H-indol-2-ylidene]-4-methylhepta-1,3,5-trien-1-yl}-3,3-dimethyl-1-(2-sulfonatoethyl)-3H-indolium-5-sulfonate
CHEBI:68631
chebi:68631 		tetrasulfocyanine acid
2-(2-{(1E,3E,5E,7E)-7-[3,3-dimethyl-5-sulfo-1-(2-sulfoethyl)-1,3-dihydro-2H-indol-2-ylidene]-4-methylhepta-1,3,5-trien-1-yl}-3,3-dimethyl-5-sulfo-3H-indolium-1-yl)ethanesulfonate