| Record Information |
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| Version | 1.0 |
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| Creation Date | 2014-08-29 06:51:44 UTC |
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| Update Date | 2016-11-09 01:09:09 UTC |
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| Accession Number | CHEM003480 |
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| Identification |
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| Common Name | Maneb |
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| Class | Small Molecule |
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| Description | Maneb is a foliate fungicide and is a polymeric complex of manganese with the ethylene bis(dithiocarbamate) anionic ligand to control a wide range of diseases including blight, leaf spot, rust, downy mildew and scab. Its mode of action is non-specific with protective action. |
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| Contaminant Sources | - Clean Air Act Chemicals
- FooDB Chemicals
- HPV EPA Chemicals
- IARC Carcinogens Group 3
- T3DB toxins
- ToxCast & Tox21 Chemicals
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| Contaminant Type | - Food Toxin
- Fungicide
- Organic Compound
- Pesticide
- Pollutant
- Synthetic Compound
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| Chemical Structure | |
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| Synonyms | | Value | Source |
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| Manganese ethane-1,2-diyldicarbamodithioate | ChEBI | | Manganese ethane-1,2-diyldicarbamodithioic acid | Generator | | Manganese(2+) ion ({2-[(sulphanidylmethanethioyl)amino]ethyl}carbamothioyl)sulphanide | Generator |
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| Chemical Formula | C4H6MnN2S4 |
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| Average Molecular Mass | 265.302 g/mol |
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| Monoisotopic Mass | 264.879 g/mol |
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| CAS Registry Number | 12427-38-2 |
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| IUPAC Name | manganese(2+) ion ({2-[(sulfanidylmethanethioyl)amino]ethyl}carbamothioyl)sulfanide |
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| Traditional Name | manganese(2+) ion ({2-[(sulfanidylmethanethioyl)amino]ethyl}carbamothioyl)sulfanide |
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| SMILES | [Mn++].[S-]C(=S)NCCNC([S-])=S |
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| InChI Identifier | InChI=1S/C4H8N2S4.Mn/c7-3(8)5-1-2-6-4(9)10;/h1-2H2,(H2,5,7,8)(H2,6,9,10);/q;+2/p-2 |
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| InChI Key | YKSNLCVSTHTHJA-UHFFFAOYSA-L |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as ethylene bisdithiocarbamates. These are dithiocarbamic acids (or derivatives) resulting from the formal addition of a molecule of carbon disulfide to each amino group of ethylenediamine. In addition, compounds containing a 1,2-ethanediyl carbamodithioate moiety are also members of this class. |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Dithiocarbamic acids and derivatives |
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| Sub Class | Dithiocarbamic acid esters |
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| Direct Parent | Ethylene bisdithiocarbamates |
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| Alternative Parents | |
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| Substituents | - Ethylene bisdithiocarbamate
- Metallobisdithiocarbamate
- Organic transition metal salt
- Organic nitrogen compound
- Organopnictogen compound
- Hydrocarbon derivative
- Organic salt
- Organosulfur compound
- Organonitrogen compound
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | |
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| Biological Properties |
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| Status | Detected and Not Quantified |
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| Origin | Exogenous |
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| Cellular Locations | - Cytosol
- Extracellular
- Membrane
- Microtubule
- Mitochondrion
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| Biofluid Locations | Not Available |
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| Tissue Locations | Not Available |
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| Pathways | | Name | SMPDB Link | KEGG Link |
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| Proteasome | Not Available | Not Available | | Cell cycle | Not Available | map04110 | | Apoptosis | Not Available | map04210 | | Base excision repair | Not Available | map03410 |
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| Applications | |
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| Biological Roles | |
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| Chemical Roles | Not Available |
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| Physical Properties |
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| State | Solid |
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| Appearance | White powder. |
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| Experimental Properties | | Property | Value |
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| Melting Point | Not Available | | Boiling Point | Not Available | | Solubility | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | | Spectrum Type | Description | Splash Key | View |
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| Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-014i-0970000000-bd04192fb9297a02e9f6 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-014i-2910000000-87155ca8228855dbb478 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-0f89-8900000000-aa41ffdc6ce1ec6e6a67 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-004i-0900000000-e438dbb8fe34bc162299 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-004i-0900000000-7687befd4089949ee9ee | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-05nf-9200000000-c1de1ffd0dcea15a2820 | Spectrum |
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| Toxicity Profile |
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| Route of Exposure | Not Available |
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| Mechanism of Toxicity | Not Available |
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| Metabolism | Not Available |
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| Toxicity Values | Not Available |
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| Lethal Dose | Not Available |
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| Carcinogenicity (IARC Classification) | 3, not classifiable as to its carcinogenicity to humans. (1) |
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| Uses/Sources | This is a man-made compound that is used as a pesticide. |
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| Minimum Risk Level | Not Available |
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| Health Effects | Not Available |
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| Symptoms | Not Available |
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| Treatment | Not Available |
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| Concentrations |
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| Not Available |
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| External Links |
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| DrugBank ID | Not Available |
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| HMDB ID | HMDB0303500 |
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| FooDB ID | FDB014836 |
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| Phenol Explorer ID | Not Available |
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| KNApSAcK ID | Not Available |
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| BiGG ID | Not Available |
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| BioCyc ID | Not Available |
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| METLIN ID | Not Available |
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| PDB ID | Not Available |
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| Wikipedia Link | Not Available |
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| Chemspider ID | 2297517 |
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| ChEBI ID | Not Available |
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| PubChem Compound ID | 25553 |
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| Kegg Compound ID | Not Available |
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| YMDB ID | Not Available |
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| ECMDB ID | Not Available |
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| References |
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| Synthesis Reference | Not Available |
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| MSDS | Not Available |
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| General References | Not Available |
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