7-[[2,5-dihydroxy-7-sulfo-6-[[4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]naphthalen-1-yl]diazenyl]-8-hydroxynaphthalene-1,3,5-trisulfonic acid (CHEM346044)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 15:03:22 UTC | ||||||||
| Update Date | 2026-08-31 15:03:22 UTC | ||||||||
| Accession Number | CHEM346044 | ||||||||
| Identification | |||||||||
| Common Name | 7-[[2,5-dihydroxy-7-sulfo-6-[[4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]naphthalen-1-yl]diazenyl]-8-hydroxynaphthalene-1,3,5-trisulfonic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 7-[[2,5-dihydroxy-7-sulfo-6-[[4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]naphthalen-1-yl]diazenyl]-8-hydroxynaphthalene-1,3,5-trisulfonic acid has the chemical formula C30H18Cl3N7O15S4. With an average molecular weight of 951.10 g/mol, 7-[[2,5-dihydroxy-7-sulfo-6-[[4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]naphthalen-1-yl]diazenyl]-8-hydroxynaphthalene-1,3,5-trisulfonic acid is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C30H18Cl3N7O15S4 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 948.881 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 7-[[2,5-dihydroxy-7-sulfo-6-[[4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]naphthalen-1-yl]diazenyl]-8-hydroxynaphthalene-1,3,5-trisulfonic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | C1=CC(=CC=C1NC2=C(C(=NC(=N2)Cl)Cl)Cl)N=NC3=C(C=C4C(=C3O)C=CC(=C4N=NC5=CC(=C6C=C(C=C(C6=C5O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)O)S(=O)(=O)O | ||||||||
| InChI Identifier | InChI=1S/C30H18Cl3N7O15S4/c31-23-28(32)35-30(33)36-29(23)34-11-1-3-12(4-2-11)37-40-25-21(59(53,54)55)9-15-14(26(25)42)5-6-18(41)24(15)39-38-17-10-19(57(47,48)49)16-7-13(56(44,45)46)8-20(58(50,51)52)22(16)27(17)43/h1-10,41-43H,(H,34,35,36)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55) | ||||||||
| InChI Key | LGVWBQHLBZARGD-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
