Bicyclopyrone

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
herbicide CHEBI:24527	A substance used to destroy plant 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

4-hydroxy-3-({2-[(2-methoxyethoxy)methyl]-6-(trifluoromethyl)pyridin-3-yl}carbonyl)bicyclo[3.2.1]oct-3-en-2-one
4-hydroxy-3-[[2-[(2-methoxyethoxy)methyl]-6-(trifluoromethyl)-3-pyridinyl]carbonyl]bicyclo[3.2.1]oct-3-en-2-one
4-hydroxy-3-{2-[(2-methoxyethoxy)methyl]-6-(trifluoromethyl)-3-pyridylcarbonyl}bicyclo[3.2.1]oct-3-en-2-one
rac-(1R,5R)-4-hydroxy-3-{2-[(2-methoxyethoxy)methyl]-6-(trifluoromethyl)pyridine-3-carbonyl}bicyclo[3.2.1]oct-3-en-2-one

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	HUYBEDCQLAEVPD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C19H20F3NO5/c1-27-6-7-28-9-13-12(4-5-14(23-13)19(20,21)22)18(26)15-16(24)10-2-3-11(8-10)17(15)25/h4-5,10-11,24H,2-3,6-9H2,1H3
IUPAC name chemrof:IUPAC_name	4-hydroxy-3-({2-[(2-methoxyethoxy)methyl]-6-(trifluoromethyl)pyridin-3-yl}carbonyl)bicyclo[3.2.1]oct-3-en-2-one
Molecular formula chemrof:molecular_formula	C19H20F3NO5
Molecular mass chemrof:molecular_mass	399.365
Monoisotopic mass chemrof:monoisotopic_mass	399.129357
SMILES string chemrof:smiles_string	COCCOCc1nc(C(F)(F)F)ccc1C(=O)C1=C(O)C2CCC(C2)C1=O

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=352010-68-5	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:136271	enrich_references.chebi_id_link
pesticides	pesticides:bicyclopyrone	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/26010776	enrich_references.chebi_xrefs
reaxys	reaxys:14616529	enrich_references.chebi_xrefs

Flow	Context	Source	Unit	CFs
7d95964418d9d86686f1ef594fc476e1793bc54a	Environmental → Ground → Agricultural	ecoinvent algorithm addition	kg	0

Everything that changed this substance (0 changes)

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Flow object JSON

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}

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Bicyclopyrone

Identity

Structure

What it is used for

Alternative labels

Properties

Known URLs

Elementary flows

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