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CHEBI:79161 - (2E)-7-hydroxyhept-2-enoic acid

ChEBI IDCHEBI:79161
ChEBI Name(2E)-7-hydroxyhept-2-enoic acid
Stars
ASCII Name(2E)-7-hydroxyhept-2-enoic acid
DefinitionAn ω-hydroxy fatty acid that is trans-2-heptenoic acid in which one of the hydrogens of the terminal methyl group is replaced by a hydroxy group.
Last Modified24 January 2023
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H12O3
Net Charge0
Average Mass144.170
Monoisotopic Mass144.07864
SMILESO=C(O)/C=C/CCCCO
InChIInChI=1S/C7H12O3/c8-6-4-2-1-3-5-7(9)10/h3,5,8H,1-2,4,6H2,(H,9,10)/b5-3+
InChIKeyDJIWUWVCLSPORR-HWKANZROSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(2E)-7-hydroxyhept-2-enoic acid (CHEBI:79161) is a hydroxy monounsaturated fatty acid (CHEBI:131869)
(2E)-7-hydroxyhept-2-enoic acid (CHEBI:79161) is a straight-chain fatty acid (CHEBI:59202)
(2E)-7-hydroxyhept-2-enoic acid (CHEBI:79161) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
(2E)-7-hydroxyhept-2-enoic acid (CHEBI:79161) is a ω-hydroxy-medium-chain fatty acid (CHEBI:194303)
Incoming Relation(s)
oscr#7 (CHEBI:79132) has functional parent (2E)-7-hydroxyhept-2-enoic acid (CHEBI:79161)
Synonym  Source
7-hydroxy-trans-2-heptenoic acidChEBI
Registry NumbersSources
Reaxys:1904098Reaxys