Consensus flow list

Identity

Type
NeutralMolecule
CAS
10004-44-1
EC
233-000-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Hymexazol

What it is used for

3

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
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

14

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string KGVPNLBXJKTABS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)
IUPAC name chemrof:IUPAC_name 3-Hydroxy-5-methylisoxazole
Molecular formula chemrof:molecular_formula C4H5NO2
Molecular mass chemrof:molecular_mass 99.089
Monoisotopic mass chemrof:monoisotopic_mass 99.032028, 99.03203
SMILES string chemrof:smiles_string Cc1cc(O)no1

Known URLs

18

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=10004-44-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:5827 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.029.988 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3032622 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=217971 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL244877 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/20T2M875LO enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.115A enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C11103 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C11103 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=67693 enrich_references.pubchem_identifier_url
pesticides pesticides:hymexazol enrich_references.chebi_xrefs
ppdb ppdb:388 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/24781 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/21959994 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22307860 enrich_references.chebi_xrefs
reaxys reaxys:606046 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q16512783 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
29061470-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a4-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
8f55138d-7bf2-4297-939c-a08ae87cd7f3 Environmental → Air → Indoor EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a3-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-92a5-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a2-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a0-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a9-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
ed338c181e1cb513261b8dd4fd318ac82b0f424f Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
4d9a8790-3ddd-11dd-92a1-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a7-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-92aa-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a6-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
4d9a8790-3ddd-11dd-92a8-0050c2490048 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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