Prometryn
fo-2f43f9ac975e1f74
Identity
- Type
- Neutral molecule
- CAS
- 7287-19-6
- EC
- 230-711-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
What it is used for
3
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| environmental contaminant CHEBI:78298 | Any minor or unwanted substance introduced into the environment that can have undesired effects. | ChEBI |
| herbicide CHEBI:24527 | A substance used to destroy plant pests. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
37- 1,3,5-Triazine-2,4-diamine, N,N′-bis(1-methylethyl)-6-(methylthio)-
- 1,3,5-Triazine-2,4-diamine, N2,N4-bis(1-methylethyl)-6-(methylthio)-
- 2,4-Bis(isopropylamino)-6-(methylthio)-s-triazine
- 2,4-Bis(isopropylamino)-6-methylmercapto-s-triazine
- 2-(methylthio)-4,6-bis(isopropylamino)-s-triazine
- 2-(Methylthio)-4,6-diisopropylamino-1,3,5-triazine
- 2-Methylmercapto-4,6-bis(isopropylamino)-1,3,5-triazine
- 2-Methylmercapto-4,6-bis(isopropylamino)-s-triazine
- 2-Methylthio-4,6-bis(isopropylamino)-1,3,5-triazine
- 2-Methylthio-4,6-bis(isopropylamino)-s-triazine
- 2-Methylthio-4,6-bis(isopropylamino)-sym-triazine
- 4,6-Bis(isopropylamino)-2-(methylthio)-1,3,5-triazine
- 4,6-Bis(isopropylamino)-2-(methylthio)-s-triazine
- 6-(methylsulfanyl)-N,N'-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
- Azogard
- Caparol
- Cosatrin
- Gesagard
- Gesagard 50
- Mercazin
- N,N'-bis(1-methylethyl)-6-methylthio-1,3,5-triazine-2,4-diamine
- N,N'-diisopropyl-6-(methylthio)-1,3,5-triazine-2,4-diamine
- N,N′-Bis(1-methylethyl)-6-methylthio-1,3,5-triazine-2,4-diamine
- N2,N4-Bis(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine
- Prohelan
- Promepin
- Promethrin
- Promethryn
- Prometrex
- Prometrin S 50
- Prometryne
- s-Triazine, 2,4-bis(isopropylamino)-6-(methylthio)-
- Selectin
- Selectin (herbicide)
- Selectin 50
- Selektin
- Uvon
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | AAEVYOVXGOFMJO-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15) |
| IUPAC name chemrof:IUPAC_name | 2-(methylthio)-4,6-bis(isopropylamino)-s-triazine |
| Molecular formula chemrof:molecular_formula | C10H19N5S |
| Molecular mass chemrof:molecular_mass | 241.364 |
| Monoisotopic mass chemrof:monoisotopic_mass | 241.136117, 241.13612 |
| SMILES string chemrof:smiles_string | CSc1nc(NC(C)C)nc(NC(C)C)n1 |
Known URLs
27Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=7287-19-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:26276 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.027.919 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.437.296 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4024272 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=163049 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1880257 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:1044597 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1K20TB75IL | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0256805 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.096A | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18542 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18542 | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-20941 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=53996 | enrich_references.pubchem_identifier_url |
| MetaCyc | https://metacyc.org/compound?orgid=META&id=CPD-9344 | enrich_references.chebi_xrefs |
| patent | patent:CN101971818 | enrich_references.chebi_xrefs |
| patent | patent:CN101971820 | enrich_references.chebi_xrefs |
| pesticides | pesticides:prometryn | enrich_references.chebi_xrefs |
| ppdb | ppdb:542 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/4929 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#3077 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24138459 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24485317 | enrich_references.chebi_xrefs |
| reaxys | reaxys:613575 | enrich_references.chebi_xrefs |
| umbbd.compound | umbbd.compound:c0255 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q1257341 | enrich_references.pubchem_identifier_url |
Elementary flows
15| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 290550f7-6556-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a0bf-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 2ef78b4d-f374-4a06-93c6-c4902b2e7b57 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a0be-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| fe0acd60-3ddc-11dd-a0c0-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a0bd-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a0bb-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-9928-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 0ad177e94f84abaf58c314b901e2d302f39385cb | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| fe0acd60-3ddc-11dd-a0bc-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a0c2-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 4d9a8790-3ddd-11dd-9929-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a0c1-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 3766d0d39c8834668fe769c94d8ccbb9f861e57f | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| 4d9a8790-3ddd-11dd-9927-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (58 changes)
Full record
Flow object JSON
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{
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{
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{
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{
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{
"@value": "Prohelan",
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},
{
"@value": "Promepin",
"@language": "en",
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},
{
"@value": "Promethrin",
"@language": "en",
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}
},
{
"@value": "Promethryn",
"@language": "en",
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}
},
{
"@value": "Prometrex",
"@language": "en",
"@lang": "en",
"provenance": {
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},
{
"@value": "Prometrin S 50",
"@language": "en",
"@lang": "en",
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],
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}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"230-711-3"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=230-711-3"
],
"provenance": {
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],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"http://www.w3.org/2004/02/skos/core#definition": [
{
"@value": "A diamino-1,3,5-triazine that is N,N'-di(propan-2-yl)-1,3,5-triazine-2,4-diamine substituted by a methylsulfanediyl group at position 6.",
"@language": "en",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_definition",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_26276"
],
"prov:wasDerivedFrom": "chebi.definition"
}
}
],
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"http://purl.obolibrary.org/obo/RO_0000087": [
{
"@id": "http://purl.obolibrary.org/obo/CHEBI_78298",
"rdfs:label": "environmental contaminant",
"http://www.w3.org/2004/02/skos/core#definition": "Any minor or unwanted substance introduced into the environment that can have undesired effects.",
"provenance": {
"prov:wasGeneratedBy": "chebi_roles",
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"prov:hadPrimarySource": [
"ChEBI"
],
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}
},
{
"@id": "http://purl.obolibrary.org/obo/CHEBI_24527",
"rdfs:label": "herbicide",
"http://www.w3.org/2004/02/skos/core#definition": "A substance used to destroy plant pests.",
"provenance": {
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],
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}
},
{
"@id": "http://purl.obolibrary.org/obo/CHEBI_25944",
"rdfs:label": "pesticide",
"http://www.w3.org/2004/02/skos/core#definition": "Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.",
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],
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}
}
]
}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works