EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78819 - (2E,8R)-8-hydroxynon-2-enoic acid

Default Structure
ChEBI IDCHEBI:78819
ChEBI Name(2E,8R)-8-hydroxynon-2-enoic acid
Stars
ASCII Name(2E,8R)-8-hydroxynon-2-enoic acid
DefinitionAn (ω−1)-hydroxy fatty acid that is (2E)-non-2-enoic acid in which the hydrogen at the 8 pro-R position is replaced by a hydroxy group.
Last Modified9 June 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC9H16O3
Net Charge0
Average Mass172.224
Monoisotopic Mass172.10994
SMILESC[C@@H](O)CCCC/C=C/C(=O)O
InChIInChI=1S/C9H16O3/c1-8(10)6-4-2-3-5-7-9(11)12/h5,7-8,10H,2-4,6H2,1H3,(H,11,12)/b7-5+/t8-/m1/s1
InChIKeyGZPWMQSUISJIIL-WVXIBAHESA-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,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819) is a hydroxy monounsaturated fatty acid (CHEBI:131869)
(2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819) is a medium-chain fatty acid (CHEBI:59554)
(2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
Incoming Relation(s)
ascr#3 (CHEBI:78821) has functional parent (2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819)
hbas#3 (CHEBI:79321) has functional parent (2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819)
icas#3 (CHEBI:79052) has functional parent (2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819)
mbas#3 (CHEBI:79128) has functional parent (2E,8R)-8-hydroxynon-2-enoic acid (CHEBI:78819)
IUPAC Name 
(2E,8R)-8-hydroxynon-2-enoic acid