7-bromo-5-[(1z,3z)-4-[7-bromo-2-(3-bromo-4-hydroxyphenyl)-1-benzofuran-5-yl]-2,3-disulfooxybuta-1,3-dienyl]-2-(3-bromo-4-hydroxyphenyl)-1-benzofuran-3-carboxylic acid (CHEM348500)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 19:03:02 UTC | ||||||||
| Update Date | 2026-08-31 19:03:02 UTC | ||||||||
| Accession Number | CHEM348500 | ||||||||
| Identification | |||||||||
| Common Name | 7-bromo-5-[(1z,3z)-4-[7-bromo-2-(3-bromo-4-hydroxyphenyl)-1-benzofuran-5-yl]-2,3-disulfooxybuta-1,3-dienyl]-2-(3-bromo-4-hydroxyphenyl)-1-benzofuran-3-carboxylic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C33H18Br4O14S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 1017.687 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 7-bromo-5-[(1z,3z)-4-[7-bromo-2-(3-bromo-4-hydroxyphenyl)-1-benzofuran-5-yl]-2,3-disulfooxybuta-1,3-dienyl]-2-(3-bromo-4-hydroxyphenyl)-1-benzofuran-3-carboxylic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | C1=CC(=C(C=C1C2=CC3=C(O2)C(=CC(=C3)C=C(C(=CC4=CC5=C(C(=C4)Br)OC(=C5C(=O)O)C6=CC(=C(C=C6)O)Br)OS(=O)(=O)O)OS(=O)(=O)O)Br)Br)O | ||||||||
| InChI Identifier | InChI=1S/C33H18Br4O14S2/c34-20-11-16(1-3-24(20)38)26-13-18-5-14(7-22(36)30(18)48-26)9-27(50-52(42,43)44)28(51-53(45,46)47)10-15-6-19-29(33(40)41)31(49-32(19)23(37)8-15)17-2-4-25(39)21(35)12-17/h1-13,38-39H,(H,40,41)(H,42,43,44)(H,45,46,47)/b27-9-,28-10- | ||||||||
| InChI Key | YTOARXLWNJRSLP-WYFABWFGSA-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 | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
