Consensus flow list

Identity

Type
NeutralMolecule
CAS
16752-77-5
EC
240-815-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Methomyl

What it is used for

6

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
acaricide CHEBI:22153 A substance used to destroy pests of the subclass Acari (mites and ticks). ChEBI
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. ChEBI
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. 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
nematicide CHEBI:25491 A substance used to destroy pests of the phylum Nematoda (roundworms). 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

31

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string UHXUZOCRWCRNSJ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)
IUPAC name chemrof:IUPAC_name 1-(Methylthio)acetaldehyde O-methylcarbamoyloxime
Molecular formula chemrof:molecular_formula C5H10N2O2S
Molecular mass chemrof:molecular_mass 162.214
Monoisotopic mass chemrof:monoisotopic_mass 162.046299, 162.0463
SMILES string chemrof:smiles_string CNC(=O)ON=C(C)SC

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=16752-77-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:6835 enrich_references.chebi_id_link
HMDB https://hmdb.ca/metabolites/HMDB0031804 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/C11196 enrich_references.chebi_xrefs
lincs.smallmolecule lincs.smallmolecule:LSM-24991 enrich_references.chebi_xrefs
pesticides pesticides:methomyl enrich_references.chebi_xrefs
ppdb ppdb:458 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11327381 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11758270 enrich_references.chebi_xrefs
reaxys reaxys:2042050 enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Methomyl enrich_references.chebi_xrefs

Elementary flows

16
Flow Context Source Unit CFs
3e4c8d3b-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
fe0acd60-3ddc-11dd-a942-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
4a9d642f-0ec0-4502-8f46-343758c2aeb4 Environmental → Air → Indoor EF 3.1 kg 4
fe0acd60-3ddc-11dd-a941-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a943-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
fe0acd60-3ddc-11dd-a940-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a93e-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
fe0acd60-3ddc-11dd-a947-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
650ee21272f00f5c087ee6ef7d51c2b69eef2467 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
fe0acd60-3ddc-11dd-a93f-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a945-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-94ab-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
13a2e09e224a3a58ee104026d5edeaa32b8ad5eb Environmental → Water → River bafu algorithm addition kg 0
fe0acd60-3ddc-11dd-a944-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
8458ed4e765836bd5daa4e59ed8b0c3f48a9b251 Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
fe0acd60-3ddc-11dd-a946-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
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    {
      "@value": "1-(Methylthio)ethylideneamino methylcarbamate",
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      "@value": "Du Pont Insecticide 1179",
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    {
      "@value": "Lannate 20L",
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    {
      "@value": "Lannate 25",
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    {
      "@value": "Lannate 90SP",
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    {
      "@value": "Lannate D",
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    {
      "@value": "Lannate L",
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    },
    {
      "@value": "Lannate LV",
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    },
    {
      "@value": "MeSH ID: D008724",
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      }
    },
    {
      "@value": "Mesomile",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methomyl lannate",
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    },
    {
      "@value": "Methomyl SP",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "methyl N-(methylcarbamoyloxy)ethanimidothioate",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Methyl N-[(methylcarbamoyl)oxy]thioacetimidate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl O-(methylcarbamoyl)thiolacetohydroxamate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl O-(methylcarbamyl)thiolacetohydroxamate",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Metomil",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
          "CAS:16752-77-5",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Metomur",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mie Duo Wei",
      "@language": "en",
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      "provenance": {
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    },
    {
      "@value": "N-(((methylamino)carbonyl)oxy)ethanimidothioic acid methyl ester",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "Nudrin",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Nudrin D",
      "@language": "en",
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      "provenance": {
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    },
    {
      "@value": "S-Methyl N-(methylcarbamoyloxy)thioacetimidate",
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    },
    {
      "@value": "S-Methyl N-[(methylcarbamoyl)oxy]thioacetimidate",
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  "properties": {
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