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Tricyclazole

fo-33ac2c84e489a3d7

Identity

Type
Neutral molecule
CAS
41814-78-2
EC
255-559-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for Tricyclazole

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

17

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string DQJCHOQLCLEDLL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H7N3S/c1-6-3-2-4-7-8(6)12-5-10-11-9(12)13-7/h2-5H,1H3
IUPAC name chemrof:IUPAC_name 5-methyl-1,2,4-triazolo[3,4-b]benzothiazole
Molecular formula chemrof:molecular_formula C9H7N3S
Molecular mass chemrof:molecular_mass 189.243
Monoisotopic mass chemrof:monoisotopic_mass 189.036068, 189.03607
SMILES string chemrof:smiles_string Cc1cccc2sc3nncn3c12

Known URLs

27

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=41814-78-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81783 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.050.490 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7037478 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB02891 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL357021 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R7U3MEU7VR enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0031809 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.506H enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18492 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18492 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45120 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:BEA enrich_references.chebi_xrefs
pesticides pesticides:tricyclazole enrich_references.chebi_xrefs
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL357021 enrich_references.pubchem_identifier_url
ppdb ppdb:660 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/39040 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/10888518 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15996714 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18488130 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19062069 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22933369 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23507498 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23973553 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25335466 enrich_references.chebi_xrefs
reaxys reaxys:980261 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q15632715 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
55cb408e-6c1c-4093-a8bb-bbcd262f340a Environmental → Air → Aircraft cruise height EF 3.1 kg 4
3d21331d-dc3e-474c-a4eb-68be70e92c20 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
55891607-4771-4ae4-bc4e-7cb186a03c91 Environmental → Air → Indoor EF 3.1 kg 4
3c849276-3644-421a-9069-9baec8919ebc Environmental → Air → Long-term EF 3.1 kg 0
d16ca180-b581-40ec-bfbf-5175167c9f2c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
b812bb53-5c30-4c9f-9c47-8bb56589e3bd Environmental → Air → Unknown EF 3.1 kg 4
746ccf3d-a9ec-49c7-8858-61b539bdb5a9 Environmental → Ground → Agricultural EF 3.1 kg 4
e694d399-76eb-4b1b-9a42-35ec9a4992e4 Environmental → Ground → Non-agricultural EF 3.1 kg 4
0642524079ea20d58e420da24eb6f26693f6613e Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
b1e71e60-f3dd-422d-b7a2-ab90e87c1937 Environmental → Ground → Unknown EF 3.1 kg 4
c8b3b5e7-ee8a-4892-9c0c-a0c8be2293b2 Environmental → Water → Long-term EF 3.1 kg 0
b1577e3a-5f33-48f2-b8ea-bba95d8b9cbc Environmental → Water → Ocean EF 3.1 kg 4
5eff4404-56a0-419e-b508-721291f631fd Environmental → Water → Surface water EF 3.1 kg 4
46466894-8cf4-4c74-ac3c-8cbdb415fd88 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON 
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