Consensus flow list

Identity

Type
NeutralMolecule
CAS
113036-87-6
EC
Origin
ecoinvent-3.12 hybrid_name_cas_v1
Changes
0 across every transformer

Structure

Structure diagram for Primisulfuron

What it is used for

2

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
herbicide CHEBI:24527 A substance used to destroy plant pests. Curated
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. Curated

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string GPGLBXMQFQQXDV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H10F4N4O7S/c15-11(16)28-8-5-9(29-12(17)18)20-13(19-8)21-14(25)22-30(26,27)7-4-2-1-3-6(7)10(23)24/h1-5,11-12H,(H,23,24)(H2,19,20,21,22,25)
Molecular formula chemrof:molecular_formula C14H10F4N4O7S
Molecular mass chemrof:molecular_mass 454.314
Monoisotopic mass chemrof:monoisotopic_mass 454.02063, 454.020633
SMILES string chemrof:smiles_string O=C(Nc1nc(OC(F)F)cc(OC(F)F)n1)NS(=O)(=O)c1ccccc1C(=O)O

Known URLs

4

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=113036-87-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82031 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C18883 enrich_references.chebi_xrefs
ppdb ppdb:535 enrich_references.chebi_xrefs

Elementary flows

7
Flow Context Source Unit CFs
4f81fae840bf668731a5663ce7f08acfc2c34c17 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) ecoinvent algorithm addition kg 0
d6d14273913e7f2de2f89cae0b1fffb4c1dbb0ed Environmental → Air → Unknown ecoinvent algorithm addition kg 0
00c8efef4bc3e16620f673d8e24c8a8f79ac6cc3 Environmental → Ground → Agricultural ecoinvent algorithm addition kg 0
97c994d384ba030c5302cd32c53a6eca3b550f00 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
8aebc98f26f9fff2aaeb2f3116bfd1db3d420dec Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
37571428b0f99861224330b4a0b765142b44541b Environmental → Water → Surface water ecoinvent algorithm addition kg 0
df972ea90dcfdcab23455626c798a16db032fba2 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
{
  "flow_object_id": "fo-2270827c3d53dc09",
  "prefLabel": [
    {
      "@value": "Primisulfuron",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [],
  "properties": {
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      ],
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      },
      "rdfs:label": "Molecular formula",
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    },
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    },
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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      "@value": [
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      "attested_by": {
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        "454.020633": [
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      },
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    "https://w3id.org/chemrof/elemental_charge": {
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      ],
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    "semantic_typing": {
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      "rdfs:seeAlso": [
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
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}

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