Consensus flow list

Identity

Type
NeutralMolecule
CAS
99485-76-4
EC
Origin
ecoinvent-3.12 hybrid_name_cas_v1
Changes
0 across every transformer

Structure

Structure diagram for Cumyluron

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 VYNOULHXXDFBLU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C17H19ClN2O/c1-17(2,14-9-4-3-5-10-14)20-16(21)19-12-13-8-6-7-11-15(13)18/h3-11H,12H2,1-2H3,(H2,19,20,21)
Molecular formula chemrof:molecular_formula C17H19ClN2O
Molecular mass chemrof:molecular_mass 302.805
Monoisotopic mass chemrof:monoisotopic_mass 302.11859, 302.118591
SMILES string chemrof:smiles_string CC(C)(NC(=O)NCc1ccccc1Cl)c1ccccc1

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=99485-76-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81738 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C18425 enrich_references.chebi_xrefs
ppdb ppdb:1684 enrich_references.chebi_xrefs

Elementary flows

7
Flow Context Source Unit CFs
172970c92ba0dd978ec0af945f701907860a2c3c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) ecoinvent algorithm addition kg 0
ff4f7e012b26588de31f9b276d94a557139a1346 Environmental → Air → Unknown ecoinvent algorithm addition kg 0
ca536c0be1621e67e12c33590097e1dbd6a1288a Environmental → Ground → Agricultural ecoinvent algorithm addition kg 0
f1b59023e0ad8afe791abc58ce0d25247256aef4 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
d3d9ed6d07d2b9d505b38476ef6dc158960e60fc Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
a07d0aff7a7975f46ce528953aaa51d798635a65 Environmental → Water → Surface water ecoinvent algorithm addition kg 0
dc2f7dcb6ac6e45b30e724665c726558fbf07190 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-7f94a7df09811bb4",
  "prefLabel": [
    {
      "@value": "Cumyluron",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [],
  "properties": {
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        "C17H19ClN2O"
      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
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    },
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    },
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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        "VYNOULHXXDFBLU-UHFFFAOYSA-N"
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      "rdfs:label": "Molecular mass",
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      "attested_by": {
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        ],
        "302.118591": [
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          "rdkit_pre_consensus"
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      },
      "rdfs:label": "Monoisotopic mass",
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  },
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  "classifications": {
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  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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  "http://purl.obolibrary.org/obo/RO_0000087": [
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  ]
}

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