Consensus flow list

Identity

Type
NeutralMolecule
CAS
21609-90-5
EC
244-472-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Leptophos

What it is used for

4

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
fungicide CHEBI:24127 A substance used to destroy fungal pests. 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

20

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CVRALZAYCYJELZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C13H10BrCl2O2PS/c1-17-19(20,9-5-3-2-4-6-9)18-13-8-11(15)10(14)7-12(13)16/h2-8H,1H3
IUPAC name chemrof:IUPAC_name (RS)-O-(4-bromo-2,5-dichlorophenyl) O-methyl phenylphosphonothioate
Molecular formula chemrof:molecular_formula C13H10BrCl2O2PS
Molecular mass chemrof:molecular_mass 412.06, 412.072
Monoisotopic mass chemrof:monoisotopic_mass 409.869955, 409.86996
SMILES string chemrof:smiles_string COP(=S)(Oc1cc(Cl)c(Br)cc1Cl)c1ccccc1

Known URLs

34

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
agr agr:IND89026816 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=21609-90-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82137 enrich_references.chebi_id_link
foodb.food foodb.food:FDB008471 enrich_references.chebi_xrefs
HMDB https://hmdb.ca/metabolites/HMDB0031798 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/C19003 enrich_references.chebi_xrefs
pesticides pesticides:leptophos enrich_references.chebi_xrefs
ppdb ppdb:1520 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/12537969 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/12742374 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15492452 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21152278 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21428349 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21432420 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2430007 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2431660 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2449553 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2472490 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2473232 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2481746 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/318517 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/4369913 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/4841433 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6178187 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6188603 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/64240 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/72768 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7685784 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/8720167 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/91399 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/91400 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/9198007 enrich_references.chebi_xrefs
reaxys reaxys:2152663 enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Leptophos enrich_references.chebi_xrefs

Elementary flows

14
Flow Context Source Unit CFs
9f686eb0-7fdf-4a60-8a32-a96a2b21b331 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
f09d88c5-59f4-4ad5-a2b2-23afe8134d16 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
6c9e4fd9-088a-4f53-b030-c0bc8ba8f2b6 Environmental → Air → Indoor EF 3.1 kg 4
ecf10a1a-bbc4-40ec-91b1-0294329af7d2 Environmental → Air → Long-term EF 3.1 kg 0
c78bab64-1283-4615-b503-665249d4ba46 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
aefbc9c5-5ac8-442b-9ea4-1fa03748a970 Environmental → Air → Unknown EF 3.1 kg 4
e38e5f88-c13a-44e2-9b9c-defbdacd40c1 Environmental → Ground → Agricultural EF 3.1 kg 4
98d43004-fc0c-47aa-940a-1083aaffa8d2 Environmental → Ground → Non-agricultural EF 3.1 kg 4
960257578fc9da0258629343d48a6e8522b803ff Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
83f2c7c7-709c-41e4-bbc0-e40f8322095e Environmental → Ground → Unknown EF 3.1 kg 4
cd2c3c57-982b-48e5-adf6-26843bb16800 Environmental → Water → Long-term EF 3.1 kg 0
eda26ee8-72ab-419e-ba13-78b78ff19fa2 Environmental → Water → Ocean EF 3.1 kg 4
e258cfd6-3ab4-42d9-a0ea-eeffd69c5f54 Environmental → Water → Surface water EF 3.1 kg 4
3d4a85d6-ac64-404a-935c-2effc8c83bd6 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f0806456c25ca086",
  "prefLabel": [
    {
      "@value": "Leptophos",
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        "prov:wasDerivedFrom": "legacy name field"
      }
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  ],
  "altLabel": [
    {
      "@value": "(+-)-leptophos",
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    {
      "@value": "(RS)-[O-(4-bromo-2,5-dichlorophenyl) O-methyl phenylphosphonothioate]",
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    },
    {
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      "@value": "(RS)-O-(4-bromo-2,5-dichlorophenyl) O-methyl phenylphosphonothioate",
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    },
    {
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    },
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    },
    {
      "@value": "MeSH ID: D010773",
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    },
    {
      "@value": "O-(4-Bromo-2,5-dichlorophenyl) O-methyl phenylphosphonothioate",
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      }
    },
    {
      "@value": "Oleophosvel",
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        ],
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      }
    },
    {
      "@value": "Phosphonothioic acid, P-phenyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Phosphonothioic acid, phenyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester",
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    },
    {
      "@value": "Phosvel",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "rac-O-(4-bromo-2,5-dichlorophenyl) O-methyl phenylphosphonothioate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "racemic leptophos",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_82137"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "VCS 5-D",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_82137"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Velsicol VCS 506",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Velsicol VCS-506",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    }
  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C13H10BrCl2O2PS"
      ],
      "attested_by": {
        "C13H10BrCl2O2PS": [
          "enrich_references.chebi_semantic",
          "rdkit_post_consensus"
        ]
      },
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    },
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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      "@value": [
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      "rdfs:label": "SMILES",
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        "COP(=S)(Oc1cc(Cl)c(Br)cc1Cl)c1ccccc1"
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    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
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