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Ontologies
CHEBI
Chemical Entities of Biological Interest Ontology
(CHEBI)
OBO
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Last submission date May 11, 2023
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ID
http://purl.obolibrary.org/obo/CHEBI_69299
http://purl.obolibrary.org/obo/CHEBI_69299
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_69299
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Preferred name
Swerilactone O
Synonyms
5-[(E)-3-oxobut-1-enyl]-3,4-dihydroisochromen-1-one
Raw data
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#2_STAR
obo_purl:smiles
CC(=O)C=C\c1cccc2C(=O)OCCc12
obo_purl:charge
0
obo_purl:inchikey
RINHRISDQZMBAU-AATRIKPKSA-N
obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_25212
oboinowl_gen:hasDbXref
PMID:21823575
skos:notation
CHEBI:69299
obo_purl:mass
216.23260
obo_purl:inchi
InChI=1S/C13H12O3/c1-9(14)5-6-10-3-2-4-12-11(10)7-8-16-13(12)15/h2-6H,7-8H2,1H3/b6-5+
obo_purl:has_functional_parent
http://purl.obolibrary.org/obo/CHEBI_27386
obo_purl:formula
C13H12O3
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym
5-[(E)-3-oxobut-1-enyl]-3,4-dihydroisochromen-1-one
oboinowl_gen:id
CHEBI:69299
rdfs:label
Swerilactone O
obo_purl:monoisotopicmass
216.07864
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_78840
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