Brightway Flows 1.0
GitHub

Identity

Type
Neutral molecule
CAS
51276-47-2
EC
257-102-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
20 across every transformer

Structure

Structure diagram for Glufosinate

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. 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

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string IAJOBQBIJHVGMQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H12NO4P/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)
IUPAC name chemrof:IUPAC_name (2RS)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid
Molecular formula chemrof:molecular_formula C5H12NO4P
Molecular mass chemrof:molecular_mass 181.128
Monoisotopic mass chemrof:monoisotopic_mass 181.050394
SMILES string chemrof:smiles_string CP(=O)(O)CCC(N)C(=O)O

Known URLs

9

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=51276-47-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:52136 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C05042 enrich_references.chebi_xrefs
knapsack knapsack:C00000797 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:PPQ enrich_references.chebi_xrefs
pesticides pesticides:glufosinate enrich_references.chebi_xrefs
ppdb ppdb:1540 enrich_references.chebi_xrefs
reaxys reaxys:2209267 enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Glufosinate enrich_references.chebi_xrefs

Elementary flows

8
Flow Context Source Unit CFs
efbbfc645f0e687c1142c4bd6d0ef8ea7799a1c1 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) ecoinvent algorithm addition kg 0
0ef12b316168eea04d258005dd05c3b7382054bb Environmental → Air → Unknown ecoinvent algorithm addition kg 0
812a1280-2c43-4cce-9ca0-70768ca0f90d Environmental → Ground → Agricultural EF 3.1 kg 0
f47eb43de409d59498430d726db307acb8a690e1 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
f4194de6b5a8b4c6634c1ce0984346865ad5a275 Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
aaf7e51de2ceae437afe8860290bc612103e6ecf Environmental → Water → River agribalyse algorithm addition kg 0
492eca7f75ccfabe5246c1880629234343b8eaee Environmental → Water → Surface water ecoinvent algorithm addition kg 0
9693dc7348094dedcadd51458c434132c3217c2e Environmental → Water → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (20 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-14a44fdd08950e78",
  "prefLabel": [
    {
      "@value": "Glufosinate",
      "@language": "en",
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  ],
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    {
      "@value": "(+-)-phosphinothricin",
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    },
    {
      "@value": "(2RS)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid",
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    {
      "@value": "2-Amino-4-(hydroxymethylphosphinyl)butanoic acid",
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    {
      "@value": "3-Amino-3-carboxypropylmethylphosphinic acid",
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      "@value": "4-[hydroxy(methyl)phosphinoyl]-DL-homoalanine",
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      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "A racemate comprising equimolar amounts of (2S)-gluphosinate (better known as gluphosinate-P) and (2R)-gluphosinate.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_52136"
        ],
        "prov:wasDerivedFrom": "chebi.definition"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://purl.obolibrary.org/obo/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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