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CHEBI:78831 - (2E,6R)-6-hydroxyhept-2-enoic acid

Default Structure
ChEBI IDCHEBI:78831
ChEBI Name(2E,6R)-6-hydroxyhept-2-enoic acid
Stars
ASCII Name(2E,6R)-6-hydroxyhept-2-enoic acid
DefinitionA hydroxy fatty acid that is trans-2-heptenoic acid in which the 6-pro-R hydrogen is replaced by a hydroxy group.
Last Modified9 June 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H12O3
Net Charge0
Average Mass144.170
Monoisotopic Mass144.07864
SMILESC[C@@H](O)CC/C=C/C(=O)O
InChIInChI=1S/C7H12O3/c1-6(8)4-2-3-5-7(9)10/h3,5-6,8H,2,4H2,1H3,(H,9,10)/b5-3+/t6-/m1/s1
InChIKeyGFPZLKGSTFJNHK-MXTDHUQFSA-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,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831) has functional parent (E)-hept-2-enoic acid (CHEBI:38364)
(2E,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(2E,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831) is a hydroxy monounsaturated fatty acid (CHEBI:131869)
(2E,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831) is a medium-chain fatty acid (CHEBI:59554)
(2E,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
Incoming Relation(s)
ascr#7 (CHEBI:78830) has functional parent (2E,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831)
icas#7 (CHEBI:79023) has functional parent (2E,6R)-6-hydroxyhept-2-enoic acid (CHEBI:78831)