Consensus flow list

Identity

Type
NeutralMolecule
CAS
41083-11-8
EC
255-209-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
65 across every transformer

Structure

Structure diagram for Azocyclotin

What it is used for

2

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
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

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ONHBDDJJTDTLIR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/3C6H11.C2H2N3.Sn/c3*1-2-4-6-5-3-1;1-3-2-5-4-1;/h3*1H,2-6H2;1-2H;/q;;;-1;+1
IUPAC name chemrof:IUPAC_name (1H-1,2,4-triazol-1-yl)tricyclohexylstannane
Molecular formula chemrof:molecular_formula C20H35N3Sn
Molecular mass chemrof:molecular_mass 436.232
Monoisotopic mass chemrof:monoisotopic_mass 437.18529, 437.185293
SMILES string chemrof:smiles_string c1nc[n]([Sn]([CH]2CCCCC2)([CH]2CCCCC2)[CH]2CCCCC2)n1

Known URLs

19

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:IND44606857 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=41083-11-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:2959 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.050.173 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.211.339 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2058091 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/V4YRQ367KE enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J15.830E enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C11092 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C11092 enrich_references.pubchem_identifier_url
patent patent:CN101380025 enrich_references.chebi_xrefs
patent patent:CN101380026 enrich_references.chebi_xrefs
patent patent:CN101491256 enrich_references.chebi_xrefs
patent patent:CN1729780 enrich_references.chebi_xrefs
pesticides pesticides:azocyclotin enrich_references.chebi_xrefs
ppdb ppdb:53 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/91634 enrich_references.pubchem_compound
reaxys reaxys:621636 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q410926 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
5e85435f-42c5-4917-8cff-1356cd3060d0 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
75c1ea43-3127-432e-84d3-4a1254288a5f Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
ad118f05-2285-4720-b142-b581892f2f26 Environmental → Air → Indoor EF 3.1 kg 4
dcdcad6a-181c-42dc-ba0b-ee991bbea5a5 Environmental → Air → Long-term EF 3.1 kg 0
7115c470-239a-4b64-bbbf-025c1f49004e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
6a8143e0-4213-4b29-9ecd-c04036c64a79 Environmental → Air → Unknown EF 3.1 kg 4
e7a19c71-ae49-471a-99ca-f99abbc339c3 Environmental → Ground → Agricultural EF 3.1 kg 4
f378fabe-7257-4f8f-bc5a-abc9ed7087f9 Environmental → Ground → Non-agricultural EF 3.1 kg 4
f1da32fa-a5ed-49f0-94ba-d6b04c93bb04 Environmental → Ground → Unknown EF 3.1 kg 4
9c42e34c-16ba-46a2-b441-ff9164ce954d Environmental → Water → Long-term EF 3.1 kg 0
537fcb59-f9b9-48d7-b9f3-678cb9a6986a Environmental → Water → Ocean EF 3.1 kg 4
d543fa38-2b3e-461e-a7a4-4d52a6ebe74d Environmental → Water → Surface water EF 3.1 kg 4
5b3a3268-f39b-43bd-ba51-aa7fc963ef74 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (65 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-ec4d90ba818f86de",
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      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
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  ],
  "altLabel": [
    {
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    },
    {
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    },
    {
      "@value": "1-(tricyclohexylstannyl)-1H-1,2,4-triazole",
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    {
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