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05. Industrial Uses
05. Industrial Uses
tetrasulfocyanine [CHEBI:63639] (1)
08. Chemical Category
08. Chemical Category
tetrasulfocyanine [CHEBI:63639] (1)
tetrasulfocyanine [CHEBI:63639] (1)
tetrasulfocyanine [CHEBI:63639] (1)
tetrasulfocyanine [CHEBI:63639] (1)
ChEBI Compound Accession Identifier :
[CHEBI:63639]
ChEBI Compound Description :
An organic sodium salt which is the trisodium salt of tetrasulfocyanine acid. It is an in vivo near-IR fluorescent probe for tumour imaging.
ChEBI Compound Identification Number :
63639
ChEBI InChI Value :
"InChI=1S/C32H38N2O12S4.3Na/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);;;/q;3*+1/p-3"
ChEBI InChIKey Value :
HAFZTWYRKGACLU-UHFFFAOYSA-K
ChEBI Compound Name :
tetrasulfocyanine
ChEBI SMILES Value :
[Na+].[Na+].[Na+].CC(\C=C\C=C1\N(CCS([O-])(=O)=O)c2ccc(cc2C1(C)C)S([O-])(=O)=O)=C/C=C/C1=[N+](CCS([O-])(=O)=O)c2ccc(cc2C1(C)C)S([O-])(=O)=O
ChEBI Substance ID :
135611116
ChEBI URL :
ChEBI:63639
ChemSpider ID :
8299062
Ontomatica Chemical Accession Key (OnChAKey) :
HAFZTWYRKGACLU_UHFFFAOYSA_K_000_000000
PubChem Compound ID :
10123543