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Isocarbophos

fo-7185af3841082983

Identity

Type
Neutral molecule
CAS
24353-61-5
EC
246-192-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
61 across every transformer

Structure

Structure diagram for Isocarbophos

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
insecticide CHEBI:24852 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. 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

11

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ALBJDBBTMHWCTN-UHFFFAOYSA-N, YFVOXLJXJBQDEF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H16NO4PS/c1-8(2)15-11(13)9-5-3-4-6-10(9)16-17(18)14-7-12/h3-6,8,17H,7,12H2,1-2H3
IUPAC name chemrof:IUPAC_name Isopropyl 2-((aminomethoxyphosphinothioyl)oxy)benzoate
Molecular formula chemrof:molecular_formula C11H16NO4PS
SMILES string chemrof:smiles_string CC(C)OC(=O)c1ccccc1O[PH](=S)OCN

Known URLs

11

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=24353-61-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38704 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.041.978 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7042063 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185588 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7741NPW06X enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.786.837C enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55971 enrich_references.pubchem_identifier_url
ppdb ppdb:987 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/90479 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27117953 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
079660bb-ff05-435e-9bee-1b75c1741e78 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
ff40e3b4-bba8-4a51-9d49-392350dd7637 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
94c6310f-7479-4d47-9986-01b97167babb Environmental → Air → Indoor EF 3.1 kg 2
9b7c6527-0503-44d9-a93e-58c294c53c1a Environmental → Air → Long-term EF 3.1 kg 0
b22d1275-faaf-4ad7-8080-1f32fddb2269 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
09b08c76-3b64-4910-bd34-a1b333ec869d Environmental → Air → Unknown EF 3.1 kg 2
c901a1bc-e77e-47f9-a680-2f1d26d78420 Environmental → Ground → Agricultural EF 3.1 kg 2
6e286b89-8764-40cc-b074-2b214d563bc1 Environmental → Ground → Non-agricultural EF 3.1 kg 2
938405841aa0ea7d9f0356104be6c301e2e28b77 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
b787c9dd-8ace-469c-8378-3cdfd44807ac Environmental → Ground → Unknown EF 3.1 kg 2
e0973475-d681-4490-8ee2-8931c44da10c Environmental → Water → Long-term EF 3.1 kg 0
85714300-3560-42e0-bf08-794fdc373428 Environmental → Water → Ocean EF 3.1 kg 2
b8d6244d-23be-4b1e-ad60-02de97201f28 Environmental → Water → Surface water EF 3.1 kg 2
6549a40a-769c-46ac-b8e5-39303584464c Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (61 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-7185af3841082983",
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        "https://commonchemistry.cas.org/detail?cas_rn=24353-61-5"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=24353-61-5"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "246-192-1"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=246-192-1"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@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_24852",
      "rdfs:label": "insecticide",
      "http://www.w3.org/2004/02/skos/core#definition": "Strictly, a substance intended to kill members of the class <em>Insecta</em>.  In common usage, any substance used for preventing, destroying, repelling or controlling insects.",
      "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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