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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_23248
http://purl.obolibrary.org/obo/CHEBI_23248
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_23248
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Preferred name
cinnamate
Synonyms
cinnamate
cinnamic acid, ion(1-)
3-phenyl-2-propenoic acid, ion(1-)
3-phenyl-2-propenoate
3-phenylacrylate
3-phenylprop-2-enoate
Definitions
A member of the class of cinnamates that results from the deprotonation of the carboxy group of cinnamic acid.
Raw data
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles
[H]C(=Cc1ccccc1)C([O-])=O
obo_purl:charge
-1
obo_purl:inchikey
WBYWAXJHAXSJNI-UHFFFAOYSA-M
oboinowl_gen:hasDbXref
Gmelin:328657
Beilstein:3904519
CAS:4151-45-5
obo_purl:IAO_0000115
A member of the class of cinnamates that results from the deprotonation of the carboxy group of cinnamic acid.
skos:notation
CHEBI:23248
oboinowl_gen:hasExactSynonym
cinnamate
3-phenylprop-2-enoate
obo_purl:mass
147.15068
obo_purl:inchi
InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/p-1
obo_purl:formula
C9H7O2
oboinowl_gen:hasOBONamespace
chebi_ontology
obo_purl:is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_27386
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym
cinnamic acid, ion(1-)
3-phenyl-2-propenoic acid, ion(1-)
3-phenyl-2-propenoate
3-phenylacrylate
oboinowl_gen:id
CHEBI:23248
rdfs:label
cinnamate
obo_purl:monoisotopicmass
147.04515
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_36091
http://purl.obolibrary.org/obo/CHEBI_26004
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