Consensus flow list

Kresoxim-methyl

fo-0d9630049ff16097

Identity

Type
NeutralMolecule
CAS
143390-89-0
EC
417-880-0, 604-351-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
101 across every transformer

Structure

Structure diagram for Kresoxim-methyl

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

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
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. 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

23

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ZOTBXTZVPHCKPN-HTXNQAPBSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+
Isomeric SMILES string chemrof:isomeric_smiles_string CO/N=C(/C(=O)OC)c1ccccc1COc1ccccc1C
IUPAC name chemrof:IUPAC_name Methyl (E)-alpha-(methoxyimino)-2-((2-methylphenoxy)methyl)benzeneacetate
Molecular formula chemrof:molecular_formula C18H19NO4
Molecular mass chemrof:molecular_mass 313.353
Monoisotopic mass chemrof:monoisotopic_mass 313.131408, 313.13141
SMILES string chemrof:smiles_string CON=C(C(=O)OC)c1ccccc1COc1ccccc1C

Known URLs

24

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=143390-89-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:2962 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.101.672 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.109.581 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2032558 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL203191 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0LXZ062TTB enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J588.356C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C11017 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C11017 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=70709 enrich_references.pubchem_identifier_url
pesticides pesticides:kresoxim-methyl enrich_references.chebi_xrefs
ppdb ppdb:414 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6112114 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/23197469 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23277369 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23452212 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24061350 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24210350 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24611510 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24936710 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24997920 enrich_references.chebi_xrefs
reaxys reaxys:8330581 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q1788000 enrich_references.pubchem_identifier_url

Elementary flows

27
Flow Context Source Unit CFs
64b1f554-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
35debb72-e172-4cac-ba3d-30fc1250ef80 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
1f12ecf7-0d12-448d-b2f5-f8548aab0ab2 Environmental → Air → Indoor EF 3.1 kg 4
4d9a8790-3ddd-11dd-95d3-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-95d5-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
4d9a8790-3ddd-11dd-95d2-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
08a91e70-3ddc-11dd-95c2-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
08a91e70-3ddc-11dd-95c7-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
c624a8cd11c7e32b14f1bbc60047d02173b96673 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-95c3-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
08a91e70-3ddc-11dd-95c5-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-95c8-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
08a91e70-3ddc-11dd-95c4-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
08a91e70-3ddc-11dd-95c6-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 4
7d8f8de6-dd8c-4503-9749-a30c7c0986a0 deprecated Environmental → Air → Aircraft cruise height EF 3.1 kg 4
4d9a8790-3ddd-11dd-95d4-0050c2490048 deprecated Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
aab5c4f2-c008-4316-a724-c19069915268 deprecated Environmental → Air → Indoor EF 3.1 kg 4
8db7392c-7b03-41aa-a4a0-c26a507fbc0f deprecated Environmental → Air → Long-term EF 3.1 kg 0
a2b877a7-c706-4dc4-ba4a-6a56c81db7a8 deprecated Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
f6147e3a-867c-4f4f-970a-2d2ee8ec887c deprecated Environmental → Air → Unknown EF 3.1 kg 4
8e374806-0927-45ba-bbd5-d31fa2f6cf0e deprecated Environmental → Ground → Agricultural EF 3.1 kg 4
8924aa98-f3ce-43bb-8718-cc401f85153a deprecated Environmental → Ground → Non-agricultural EF 3.1 kg 4
9f508f9a-6ec3-4060-a411-91b67a88b7f4 deprecated Environmental → Ground → Unknown EF 3.1 kg 4
85c1b9b3-59e5-4154-983e-577825f661ed deprecated Environmental → Water → Long-term EF 3.1 kg 0
6dabb931-ca96-4c5a-8ba9-7bcd79773d0d deprecated Environmental → Water → Ocean EF 3.1 kg 4
0e5a262d-948e-4a6b-8b48-53e7b29ffe06 deprecated Environmental → Water → Surface water EF 3.1 kg 4
4fc59774-0157-4dda-9fae-e0e9cfdc7d4e deprecated Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (101 changes)

Open the changes page

Full record

Flow object JSON 
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    },
    {
      "@value": "RIL-FA 200",
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    },
    {
      "@value": "Sovran",
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      "@value": "Stroby",
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  "properties": {
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