5-[[4-[[6-[[2-[(2-carboxyphenyl)diazenyl]-3-oxobutanoyl]amino]-2-hydroxy-4-sulfonaphthalen-1-yl]diazenyl]-3-methoxy-7-sulfonaphthalen-1-yl]diazenyl]-2-hydroxybenzoic acid (CHEM350804)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 22:59:13 UTC | ||||||||
| Update Date | 2026-08-31 22:59:13 UTC | ||||||||
| Accession Number | CHEM350804 | ||||||||
| Identification | |||||||||
| Common Name | 5-[[4-[[6-[[2-[(2-carboxyphenyl)diazenyl]-3-oxobutanoyl]amino]-2-hydroxy-4-sulfonaphthalen-1-yl]diazenyl]-3-methoxy-7-sulfonaphthalen-1-yl]diazenyl]-2-hydroxybenzoic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C39H29N7O15S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 899.116 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 5-[[4-[[6-[[2-[(2-carboxyphenyl)diazenyl]-3-oxobutanoyl]amino]-2-hydroxy-4-sulfonaphthalen-1-yl]diazenyl]-3-methoxy-7-sulfonaphthalen-1-yl]diazenyl]-2-hydroxybenzoic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(=O)C(C(=O)NC1=CC2=C(C=C(C(=C2C=C1)N=NC3=C(C=C(C4=C3C=CC(=C4)S(=O)(=O)O)N=NC5=CC(=C(C=C5)O)C(=O)O)OC)O)S(=O)(=O)O)N=NC6=CC=CC=C6C(=O)O | ||||||||
| InChI Identifier | InChI=1S/C39H29N7O15S2/c1-18(47)34(44-42-28-6-4-3-5-24(28)38(51)52)37(50)40-19-7-10-23-26(13-19)33(63(58,59)60)17-31(49)35(23)45-46-36-22-11-9-21(62(55,56)57)15-25(22)29(16-32(36)61-2)43-41-20-8-12-30(48)27(14-20)39(53)54/h3-17,34,48-49H,1-2H3,(H,40,50)(H,51,52)(H,53,54)(H,55,56,57)(H,58,59,60) | ||||||||
| InChI Key | KUMWMVNJLFHISJ-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 | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
