Consensus flow list

Identity

Type
NeutralMolecule
CAS
121776-33-8
EC
434-800-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Furilazole

What it is used for

1

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

Alternative labels

13

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string MCNOFYBITGAAGM-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H13Cl2NO3/c1-11(2)14(10(15)9(12)13)6-8(17-11)7-4-3-5-16-7/h3-5,8-9H,6H2,1-2H3
IUPAC name chemrof:IUPAC_name (RS)-3-(dichloroacetyl)-5-(2-furanyl)-2,2-dimethyloxazolidine
Molecular formula chemrof:molecular_formula C11H13Cl2NO3
Molecular mass chemrof:molecular_mass 278.13, 278.135
Monoisotopic mass chemrof:monoisotopic_mass 277.027249, 277.02725
SMILES string chemrof:smiles_string CC1(C)OC(c2ccco2)CN1C(=O)C(Cl)Cl

Known URLs

20

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:IND43949512 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=121776-33-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:147435 enrich_references.chebi_id_link
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:147438 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.129.424 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4041999 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2269063 enrich_references.pubchem_identifier_url
foodb.food foodb.food:FDB016125 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/G25K04N8Z5 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0037131 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.304.182B enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=47623 enrich_references.pubchem_identifier_url
pesticides pesticides:furilazole enrich_references.chebi_xrefs
ppdb ppdb:1577 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/86187 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/30223316 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/31117539 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/31892395 enrich_references.chebi_xrefs
reaxys reaxys:11343170 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q1385138 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
924dbb32-02a0-432f-8278-c776c4d30380 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
a0cc435f-e7c7-4f69-8efc-56b5e62e1f0d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
9d14695a-8435-499f-b5e0-ed14520e7e4a Environmental → Air → Indoor EF 3.1 kg 2
103329f6-d24e-43de-858b-cc4b260d470a Environmental → Air → Long-term EF 3.1 kg 0
72572904-35d2-4d34-a041-a12054540e21 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
1dbc8010-a78b-49ca-949d-6647c03315ce Environmental → Air → Unknown EF 3.1 kg 2
76288707-b6bf-4db0-92a3-eefb2030a130 Environmental → Ground → Agricultural EF 3.1 kg 2
ea14dc2f-505b-45dd-a421-8cbf039e4efb Environmental → Ground → Non-agricultural EF 3.1 kg 2
1bfac278-f90a-40ee-ba83-22ca8af119d1 Environmental → Ground → Unknown EF 3.1 kg 2
1a81a4d6-5a81-4b18-9943-ed637434ac98 Environmental → Water → Long-term EF 3.1 kg 0
8382b5b0-4aa5-4d21-97dd-ab0933e508ac Environmental → Water → Ocean EF 3.1 kg 2
962db565-0f0a-43ac-ae55-da211abb1bed Environmental → Water → Surface water EF 3.1 kg 2
df92c5af-479a-40f8-a4c9-7d69f38bbb81 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-13ca3b7cc60a96d4",
  "prefLabel": [
    {
      "@value": "Furilazole",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "altLabel": [
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      "@value": "(+-)-furilazole",
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      }
    },
    {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "(RS)-3-dichloroacetyl-5-(2-furanyl)-2,2-dimethyl-1,3-oxazolidine",
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    {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2-Dichloro-1-[5-(2-furanyl)-2,2-dimethyl-3-oxazolidinyl]ethanone",
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      }
    },
    {
      "@value": "Ethanone, 2,2-dichloro-1-[5-(2-furanyl)-2,2-dimethyl-3-oxazolidinyl]-",
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    },
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      "@value": "MON13900",
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    },
    {
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    {
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    {
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    },
    {
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  "properties": {
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