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EFO
Experimental Factor Ontology
(EFO)
OWL
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Last submission date April 15, 2025
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ID
http://purl.obolibrary.org/obo/CHEBI_16682
http://purl.obolibrary.org/obo/CHEBI_16682
https://agroportal.lirmm.fr/ontologies/EFO/CHEBI_16682
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Preferred name
N-acetyl-beta-alanine
Synonyms
3-acetamidopropanoic acid
N-Acetyl-beta-alanine
3-(acetylamino)propanoic acid
Definitions
The N-acetyl derivative of beta-alanine.
Raw data
rdf:type
http://www.w3.org/2002/07/owl#Class
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rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_33575
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http://purl.obolibrary.org/obo/CHEBI_37622
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rdfs:label
N-acetyl-beta-alanine
skos:notation
CHEBI:16682
obo_purl:IAO_0000115
The N-acetyl derivative of beta-alanine.
oboinowl_gen:hasExactSynonym
3-acetamidopropanoic acid
N-Acetyl-beta-alanine
oboinowl_gen:hasDbXref
CAS:3025-95-4
Gmelin:1317687
KEGG:C01073
MetaCyc:CPD-580
Reaxys:1704093
oboinowl_gen:hasOBONamespace
chebi_ontology
oboinowl_gen:id
CHEBI:16682
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
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oboinowl_gen:hasRelatedSynonym
3-(acetylamino)propanoic acid
oboinowl_gen:hasAlternativeId
CHEBI:12449
CHEBI:21599
CHEBI:7186
obo_purl:charge
0
obo_purl:formula
C5H9NO3
obo_purl:inchi
InChI=1S/C5H9NO3/c1-4(7)6-3-2-5(8)9/h2-3H2,1H3,(H,6,7)(H,8,9)
obo_purl:inchikey
LJLLAWRMBZNPMO-UHFFFAOYSA-N
obo_purl:mass
131.12990
obo_purl:monoisotopicmass
131.05824
obo_purl:smiles
CC(=O)NCCC(O)=O
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