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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2E,6R)-6-hydroxyhept-2-enoic acid
ChEBI ID CHEBI:78831
ChEBI ASCII Name (2E,6R)-6-hydroxyhept-2-enoic acid
Definition A hydroxy fatty acid that is trans-2-heptenoic acid in which the 6-pro-R hydrogen is replaced by a hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H12O3
Net Charge 0
Average Mass 144.16840
Monoisotopic Mass 144.07864
InChI InChI=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
InChIKey GFPZLKGSTFJNHK-MXTDHUQFSA-N
SMILES C[C@@H](O)CC\C=C\C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (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 α,β-unsaturated monocarboxylic acid (CHEBI:79020)
(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)
Incoming 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)
Last Modified
09 June 2016