Consensus flow list

Identity

Type
NeutralMolecule
CAS
98886-44-3
EC
619-377-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Fosthiazate

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
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

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string DUFVKSUJRWYZQP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H18NO3PS2/c1-4-8(3)16-14(12,13-5-2)10-6-7-15-9(10)11/h8H,4-7H2,1-3H3
IUPAC name chemrof:IUPAC_name O-ethyl S-(butan-2-yl) (2-oxo-1,3-thiazolidin-3-yl)phosphonothioate
Molecular formula chemrof:molecular_formula C9H18NO3PS2
Molecular mass chemrof:molecular_mass 283.355
Monoisotopic mass chemrof:monoisotopic_mass 283.04657, 283.046572
SMILES string chemrof:smiles_string CCOP(=O)(SC(C)CC)N1CCSC1=O

Known URLs

13

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=98886-44-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38692 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.118.576 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0034930 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1905657 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/96QJ4O095U enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J134.952J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18402 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18402 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55967 enrich_references.pubchem_identifier_url
ppdb ppdb:364 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/91758 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q1266349 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
9c1785d1-caab-4f1f-99d9-f56b0ee370e5 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
49da2d15-6404-4d1a-8297-5265a4a607f4 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
74fc047b-3169-42c6-851a-7d927330f46b Environmental → Air → Indoor EF 3.1 kg 4
ccfff23a-0be8-4e19-92a7-9bcc5b472ebb Environmental → Air → Long-term EF 3.1 kg 0
2a46fb0a-0f51-4e8c-9bc2-64299f6434c0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
3085c64f-8adb-4edf-afab-5fe670d1d475 Environmental → Air → Unknown EF 3.1 kg 4
58759f70-4570-47d2-bc10-d82115c85282 Environmental → Ground → Agricultural EF 3.1 kg 4
dc4f76c1-21cc-4e7c-8e29-fa9cab8390e1 Environmental → Ground → Non-agricultural EF 3.1 kg 4
6d409efe83af509c79bb9a8d8a2e11fb9941947a Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
5ca92a8a-581c-4ff5-9a46-22ff05b03924 Environmental → Ground → Unknown EF 3.1 kg 4
b3eeb0e1-326f-49fa-8d3d-481e43142ae9 Environmental → Water → Long-term EF 3.1 kg 0
ef4c8e1b-4d47-4321-9c5f-1035338e472f Environmental → Water → Ocean EF 3.1 kg 4
fb389314-af40-4e85-94df-bcc7dfc9585c Environmental → Water → Surface water EF 3.1 kg 4
c4c7e1db-d128-41fa-b474-a4aa6492ec8b 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
{
  "flow_object_id": "fo-37e82acbcc32c588",
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  ],
  "altLabel": [
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      "@value": "(rs)-s-sec-butyl-o-ethyl-2-oxo-1,3-thiazolidin-3-ylphosphonothioate",
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    {
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