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Thifensulfuron

fo-dddcb841fcce7182

Identity

Type
Neutral molecule
CAS
79277-67-1
EC
—
Origin
EF 3.1 hybrid_name_cas_v1
Changes
22 across every transformer

Structure

Structure diagram for Thifensulfuron

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

7

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string LOQQVLXUKHKNIA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)
IUPAC name chemrof:IUPAC_name 3-(4-methoxy-6-methyl-1,3,5-triazin-2-ylcarbamoylsulfamoyl)thiophene-2-carboxylic acid
Molecular formula chemrof:molecular_formula C11H11N5O6S2
Molecular mass chemrof:molecular_mass 373.372
Monoisotopic mass chemrof:monoisotopic_mass 373.015075
SMILES string chemrof:smiles_string COc1nc(C)nc(=NC(O)=NS(=O)(=O)c2ccsc2C(=O)O)[nH]1

Known URLs

12

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:IND21975725 enrich_references.chebi_xrefs
agr agr:IND21983041 enrich_references.chebi_xrefs
agr agr:IND21984069 enrich_references.chebi_xrefs
agr agr:IND23256565 enrich_references.chebi_xrefs
agr agr:IND44616493 enrich_references.chebi_xrefs
agr agr:IND88022327 enrich_references.chebi_xrefs
agr agr:IND89001613 enrich_references.chebi_xrefs
agr agr:IND91008589 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=79277-67-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:132053 enrich_references.chebi_id_link
pesticides pesticides:thifensulfuron enrich_references.chebi_xrefs
ppdb ppdb:972 enrich_references.chebi_xrefs

Elementary flows

7
Flow Context Source Unit CFs
0d4f2a3a-2a4e-42ae-ab1d-f1d06a9554d3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
4402148e60c40410f6f2720a51cbc5fc12cabf2f Environmental → Air → Unknown ecoinvent algorithm addition kg 0
b01592873661825fe89c81cb7b6bf298fcd7cbc7 Environmental → Ground → Agricultural ecoinvent algorithm addition kg 0
d2d86e1a85aeb6369adf698ea378fd91b9cdeaff Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
6276ce7bc05bf2f131c5ad55540ae8cd861f6d87 Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
570e1b42e5ac9844526f02216c7fced695b315cc Environmental → Water → Surface water ecoinvent algorithm addition kg 0
dc4ce6438000dbc267aa04db6dbb517f210f52e6 Environmental → Water → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (22 changes)

Open the changes page

Full record

Flow object JSON 
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      "provenance": {
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      }
    }
  },
  "classifications": {
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      "@value": [
        "79277-67-1"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=79277-67-1"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=79277-67-1"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      },
      "per_value_provenance": {
        "79277-67-1": {
          "prov:wasGeneratedBy": "commonchem_cas_review",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ],
          "prov:wasDerivedFrom": "Common Chemistry exact-name CAS fill-in"
        }
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "An N-sulfonylurea in which the sulfur atom is attached to a 2-carboxythiophen-3-yl group and in which the non-sulfonated nitrogen is substituted by a 4-methoxy-6-methyl-1,3,5-triazin-2-yl group. The corresponding methyl ester, known as thifensulfuron-methyl, is used as a post-emergence herbicide for the control of grass and broad-leaved weeds.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_132053"
        ],
        "prov:wasDerivedFrom": "chebi.definition"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://purl.obolibrary.org/obo/RO_0000087": [
    {
      "@id": "http://purl.obolibrary.org/obo/CHEBI_33286",
      "rdfs:label": "agrochemical",
      "http://www.w3.org/2004/02/skos/core#definition": "An agrochemical is a substance that is used in agriculture or horticulture.",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_roles",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ChEBI"
        ],
        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
      }
    },
    {
      "@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": {
        "prov:wasGeneratedBy": "chebi_roles",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ChEBI"
        ],
        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
      }
    },
    {
      "@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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