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ECTO
Environmental Conditions, Treatments and Exposures Ontology
(ECTO)
OWL
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Last submission date April 10, 2024
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ID
http://purl.obolibrary.org/obo/CHEBI_17217
http://purl.obolibrary.org/obo/CHEBI_17217
https://agroportal.lirmm.fr/ontologies/ECTO/CHEBI_17217
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Preferred name
2-butenoic acid
Synonyms
acide crotonique
alpha-crotonic acid
Crotonsaeure
beta-methylacrylic acid
Crotonic acid
but-2-enoic acid
beta-methacrylic acid
2-Butenoic acid
3-methylacrylic acid
2-Butenoate
CTA
alpha-butenoic acid
2-butenic acid
Definitions
A butenoic acid having the double bond at position C-2.
Raw data
oboinowl_gen:hasAlternativeId
CHEBI:19485
CHEBI:1027
CHEBI:19484
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles
[H]C(C)=CC(O)=O
obo_purl:charge
0
obo_purl:inchikey
LDHQCZJRKDOVOX-UHFFFAOYSA-N
oboinowl_gen:hasDbXref
Reaxys:1098434
Beilstein:1098434
CAS:3724-65-0
KEGG:C01771
Gmelin:324286
obo_purl:IAO_0000115
A butenoic acid having the double bond at position C-2.
skos:notation
CHEBI:17217
oboinowl_gen:hasExactSynonym
but-2-enoic acid
2-Butenoic acid
obo_purl:mass
86.08924
obo_purl:inchi
InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)
obo_purl:formula
C4H6O2
obo_purl:is_conjugate_acid_of
http://purl.obolibrary.org/obo/CHEBI_36258
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym
acide crotonique
alpha-crotonic acid
Crotonsaeure
beta-methylacrylic acid
Crotonic acid
beta-methacrylic acid
3-methylacrylic acid
2-Butenoate
CTA
alpha-butenoic acid
2-butenic acid
oboinowl_gen:id
CHEBI:17217
rdfs:label
2-butenoic acid
obo_purl:monoisotopicmass
86.03678
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_79020
http://purl.obolibrary.org/obo/CHEBI_22959
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