Consensus flow list

Identity

Type
NeutralMolecule
CAS
79127-80-3
EC
683-267-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for Fenoxycarb

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

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string HJUFTIJOISQSKQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)
IUPAC name chemrof:IUPAC_name (2-(4-phenoxyphenoxy)ethyl)carbamic acid ethyl ester
Molecular formula chemrof:molecular_formula C17H19NO4
Molecular mass chemrof:molecular_mass 301.342
Monoisotopic mass chemrof:monoisotopic_mass 301.131408, 301.13141
SMILES string chemrof:smiles_string CCOC(=O)NCCOc1ccc(Oc2ccccc2)cc1

Known URLs

25

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=79127-80-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:5009 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.069.702 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.208.787 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7032393 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL15780 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/JEN0LSV1G9 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252212 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J296.319A enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C11078 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C11078 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=53169 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C163658 enrich_references.pubchem_identifier_url
patent patent:CN103651557 enrich_references.chebi_xrefs
patent patent:US4215135 enrich_references.chebi_xrefs
pesticides pesticides:fenoxycarb enrich_references.chebi_xrefs
ppdb ppdb:304 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/51605 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3077 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/19898762 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2098484 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2904969 enrich_references.chebi_xrefs
reaxys reaxys:6932817 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q415472 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Fenoxycarb enrich_references.chebi_xrefs

Elementary flows

14
Flow Context Source Unit CFs
fbf12ba0-24af-4567-a58e-95d3a7eda869 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
49d8e959-ef03-440e-a3d3-84f4e530c845 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
b908d59f-41cb-404c-8cf3-df4f4e5d5401 Environmental → Air → Indoor EF 3.1 kg 2
07324862-72cf-4339-9ca7-d72264a2485a Environmental → Air → Long-term EF 3.1 kg 0
9efeb204-dc12-465b-b051-897fa8b644d7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b434663c-272a-4cc3-b704-b0a9e6d272dd Environmental → Air → Unknown EF 3.1 kg 2
ac795010-baad-4d80-9ad0-2fc999819ae0 Environmental → Ground → Agricultural EF 3.1 kg 2
f4f05a80-5cc5-40f1-8ba4-02593ccb8b60 Environmental → Ground → Non-agricultural EF 3.1 kg 2
effcc7b021ea050ba55d26506e492d93000f3fc0 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
dbc1bbe6-7427-4984-ab98-755d8da89557 Environmental → Ground → Unknown EF 3.1 kg 2
e066f614-c0a3-4d66-bd65-9fda834eab8b Environmental → Water → Long-term EF 3.1 kg 0
51223131-447f-4b93-bcf6-d1790e3cf27a Environmental → Water → Ocean EF 3.1 kg 2
1b2b4457-ea16-4198-b821-a18fdc420cd1 Environmental → Water → Surface water EF 3.1 kg 2
de836c61-6a08-49d8-babf-5e3cfdabaf53 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON
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