CHEBI:78850 - (2E,7R)-7-hydroxyoct-2-enoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2E,7R)-7-hydroxyoct-2-enoic acid
ChEBI ID CHEBI:78850
ChEBI ASCII Name (2E,7R)-7-hydroxyoct-2-enoic acid
Definition An (ω−1)-hydroxy fatty acid that is (2E)-oct-2-enoic acid in which the hydrogen at the 7-pro-R position is replaced by a hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C8H14O3
Net Charge 0
Average Mass 158.19500
Monoisotopic Mass 158.09429
InChI InChI=1S/C8H14O3/c1-7(9)5-3-2-4-6-8(10)11/h4,6-7,9H,2-3,5H2,1H3,(H,10,11)/b6-4+/t7-/m1/s1
InChIKey TWDBRKLFYIPUTJ-PTYLAXBQSA-N
SMILES C[C@@H](O)CCC\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,7R)-7-hydroxyoct-2-enoic acid (CHEBI:78850) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
(2E,7R)-7-hydroxyoct-2-enoic acid (CHEBI:78850) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(2E,7R)-7-hydroxyoct-2-enoic acid (CHEBI:78850) is a hydroxy monounsaturated fatty acid (CHEBI:131869)
(2E,7R)-7-hydroxyoct-2-enoic acid (CHEBI:78850) is a medium-chain fatty acid (CHEBI:59554)
Incoming ascr#13 (CHEBI:78851) has functional parent (2E,7R)-7-hydroxyoct-2-enoic acid (CHEBI:78850)
Last Modified
09 June 2016