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Triflusulfuron

fo-abe3fae6eb721029

Identity

Type
Neutral molecule
CAS
135990-29-3
EC
—
Origin
ecoinvent-3.12 hybrid_name_cas_v1
Changes
0 across every transformer

Structure

Structure diagram for Triflusulfuron

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
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. 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

4

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string AKTQJCBOGPBERP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H17F3N6O6S/c1-8-5-4-6-9(11(26)27)10(8)32(29,30)24-14(28)21-12-20-13(25(2)3)23-15(22-12)31-7-16(17,18)19/h4-6H,7H2,1-3H3,(H,26,27)(H2,20,21,22,23,24,28)
IUPAC name chemrof:IUPAC_name 2-(N-{[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)-3-methylbenzoic acid
Molecular formula chemrof:molecular_formula C16H17F3N6O6S
Molecular mass chemrof:molecular_mass 478.409
Monoisotopic mass chemrof:monoisotopic_mass 478.088238, 478.08824
SMILES string chemrof:smiles_string Cc1cccc(C(=O)O)c1S(=O)(=O)NC(=O)Nc1nc(OCC(F)(F)F)nc(N(C)C)n1

Known URLs

7

Where 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
agr agr:IND20479235 enrich_references.chebi_xrefs
agr agr:IND21983365 enrich_references.chebi_xrefs
agr agr:IND23212840 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=135990-29-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:142847 enrich_references.chebi_id_link
pesticides pesticides:triflusulfuron enrich_references.chebi_xrefs
ppdb ppdb:1557 enrich_references.chebi_xrefs

Elementary flows

7
Flow Context Source Unit CFs
2f0ea4f81cb8c849cdac5b9899ed002539abb035 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) ecoinvent algorithm addition kg 0
f6ee8e69ccaa88a09c5aca65e4a7e79007643986 Environmental → Air → Unknown ecoinvent algorithm addition kg 0
98148630c2ee8e0510be65ca8e91cc1bccd3ff12 Environmental → Ground → Agricultural ecoinvent algorithm addition kg 0
ba0bf55cefb1d2d58e28dadfdbc54d87a3af2887 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
c55c4c7e8bc1784607afc632523942b0c1e6b678 Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
1e0d83e419f47bcde668a36c9e025560ce81b2ab Environmental → Water → Surface water ecoinvent algorithm addition kg 0
0f775bead551a5ece20e9194e51ffc2bac0e1b58 Environmental → Water → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (0 changes)

Open the changes page

Full record

Flow object JSON 
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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.",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_roles",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ChEBI"
        ],
        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
      }
    }
  ]
}

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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

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