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Formetanate

fo-37e0088ec406131c

Identity

Type
Neutral molecule
CAS
22259-30-9
EC
244-879-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Formetanate

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
acaricide CHEBI:22153 A substance used to destroy pests of the subclass Acari (mites and ticks). ChEBI
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
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

13

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RMFNNCGOSPBBAD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H15N3O2/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3/h4-8H,1-3H3,(H,12,15)
IUPAC name chemrof:IUPAC_name 3-{[(dimethylamino)methylidene]amino}phenyl methylcarbamate
Molecular formula chemrof:molecular_formula C11H15N3O2
Molecular mass chemrof:molecular_mass 221.26
Monoisotopic mass chemrof:monoisotopic_mass 221.116427, 221.11643
SMILES string chemrof:smiles_string CNC(=O)Oc1cccc(N=CN(C)C)c1

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
beilstein beilstein:2807600 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=22259-30-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38491 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.040.784 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9041990 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1907183 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3303111 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/532HEC1KKM enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252444 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.763D enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18668 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18668 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55886 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C163660 enrich_references.pubchem_identifier_url
ppdb ppdb:360 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/31099 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q1027605 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Formetanate enrich_references.pubchem_identifier_url

Elementary flows

15
Flow Context Source Unit CFs
c34a6b3a-9a85-4bcc-8302-28667eeb7993 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4a107ab2-4005-47b2-9633-d3976eb821f1 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
00ac7011-914b-45e3-950e-ec991b245dec Environmental → Air → Indoor EF 3.1 kg 2
b2368194-9ad1-4fa1-8b71-d54e95df4524 Environmental → Air → Long-term EF 3.1 kg 0
fcc6120b-4667-4a23-bfb0-0319d53ff47a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
7d07b8ff-9391-46f1-8a31-615f9488edd5 Environmental → Air → Unknown EF 3.1 kg 2
cee620ca-30bb-433f-9e85-55ac40d77f5c Environmental → Ground → Agricultural EF 3.1 kg 2
9dbe6344-0a88-4198-b669-37cf62847b72 Environmental → Ground → Non-agricultural EF 3.1 kg 2
d0850559a5f3018a1bc59aa1cfaee056f1d1e333 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
ddf47776-0b5e-4088-ba31-ce52bf1224e2 Environmental → Ground → Unknown EF 3.1 kg 2
51237fa2-2e57-439f-a980-8e2d05976840 Environmental → Water → Long-term EF 3.1 kg 0
4f279339-6fbe-401d-b540-b5f5c93d6da8 Environmental → Water → Ocean EF 3.1 kg 2
8db4ff6cb478ecf56e0f6b775fcdacee4d51b6ba Environmental → Water → River agribalyse algorithm addition kg 0
6165e802-6193-40b6-b63d-9320657ffc37 Environmental → Water → Surface water EF 3.1 kg 2
cc45da28-2def-4e7d-be86-d0cb2bfda987 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
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