Consensus flow list

Identity

Type
Molecular complex
CAS
38641-94-0
EC
254-056-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Roundup

Alternative labels

101

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ZEKANFGSDXODPD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H8NO5P.C3H9N/c5-3(6)1-4-2-10(7,8)9;1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3H,4H2,1-2H3
IUPAC name chemrof:IUPAC_name N-(phosphonomethyl)glycine - isopropylamine (1:1)
Molecular formula chemrof:molecular_formula C3H8NO5P.C3H9N, C6H17N2O5P
Molecular mass chemrof:molecular_mass 228.185
Monoisotopic mass chemrof:monoisotopic_mass 228.087508, 228.08751
SMILES string chemrof:smiles_string CC(C)N.O=C(O)CNCP(=O)(O)O

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=38641-94-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81834 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.049.125 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.216.627 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0034649 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/BJX3508RLJ enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18564 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18564 enrich_references.pubchem_identifier_url
pesticides pesticides:derivatives/glyphosate-isopropylammonium enrich_references.chebi_xrefs
ppdb ppdb:2395 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/38078 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27155621 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
3e4d5072-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1b5-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
63f5a3e2-c72c-4686-b4fc-ce90ef882e96 Environmental → Air → Indoor EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1b4-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a1b6-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1b3-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1b1-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-9332-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
566576dc990429696619c30ee30e0c6d40ad2f69 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
fe0acd60-3ddc-11dd-a1b2-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
4d9a8790-3ddd-11dd-9a5d-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9333-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
4d9a8790-3ddd-11dd-9a5c-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
4d9a8790-3ddd-11dd-9a5e-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-a89a9a4db5f31b91",
  "prefLabel": [
    {
      "@value": "Roundup",
      "@language": "en",
      "@lang": "en",
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-Propanamine, compd. with N-(phosphonomethyl)glycine (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "[(phosphonomethyl)amino]acetic acid - propan-2-amine (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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    },
    {
      "@value": "Accord concentrate (herbicide)",
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    },
    {
      "@value": "Amega",
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    },
    {
      "@value": "AquaMaster",
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    {
      "@value": "Atut",
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      "@value": "Azural AT",
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    {
      "@value": "Bayer Glyphosate Concentrate",
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    },
    {
      "@value": "Buccaneer Plus",
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      "@value": "Cargly",
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    },
    {
      "@value": "Ceresate",
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    },
    {
      "@value": "Clinic Ace",
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    },
    {
      "@value": "Clinic E.V.",
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      }
    },
    {
      "@value": "Corphosate",
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      }
    },
    {
      "@value": "Cosmic",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cosmic (herbicide)",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Credit",
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        ],
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      }
    },
    {
      "@value": "Cuspide 480SL",
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      }
    },
    {
      "@value": "Durango",
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    },
    {
      "@value": "Eraser (herbicide)",
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    },
    {
      "@value": "Excel Mera 71",
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        ],
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      }
    },
    {
      "@value": "Fakel",
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    },
    {
      "@value": "Fosulen",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Gallup 360SL",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Glifene SL",
      "@language": "en",
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    },
    {
      "@value": "Glifocyd",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glifogan",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Glifosato Atanor",
      "@language": "en",
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      "provenance": {
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        ],
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    },
    {
      "@value": "Glycine, N-(phosphonomethyl)-, compd. with 2-propanamine (1:1)",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glyfos AU",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glyfos BIO",
      "@language": "en",
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      }
    },
    {
      "@value": "Glyphogan",
      "@language": "en",
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    },
    {
      "@value": "Glyphogan Classic",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "Glyphomax Plus",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Glyphomax XRT",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glyphosate AKB 480",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glyphosate AKB 80",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glyphosate Atanor 48",
      "@language": "en",
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  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/MolecularComplex"
  ]
}

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