EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:138325 - (5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid

ChEBI IDCHEBI:138325
ChEBI Name(5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid
Stars
ASCII Name(5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid
DefinitionA hydroperoxy(hydroxy)icosatetraenoic acid that is (6E,8Z,11Z,13E)-icosatetraenoic acid in which the hydroxy and hydroperoxy substituents are located at positions 5S and 15S respectively.
Last Modified29 August 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H32O5
Net Charge0
Average Mass352.471
Monoisotopic Mass352.22497
SMILESCCCCC[C@@H](/C=C/C=C\C/C=C\C=C\[C@@H](O)CCCC(=O)O)OO
InChIInChI=1S/C20H32O5/c1-2-3-9-15-19(25-24)16-11-8-6-4-5-7-10-13-18(21)14-12-17-20(22)23/h5-8,10-11,13,16,18-19,21,24H,2-4,9,12,14-15,17H2,1H3,(H,22,23)/b7-5-,8-6-,13-10+,16-11+/t18-,19+/m1/s1
InChIKeyWILWDBJHNLQDON-WZXFMMTGSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound.
ChEBI Ontology
Outgoing Relation(s)
(5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid (CHEBI:138325) is a hydroperoxy(hydroxy)icosatetraenoic acid (CHEBI:138327)
(5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid (CHEBI:138325) is a secondary allylic alcohol (CHEBI:134396)
(5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid (CHEBI:138325) is conjugate acid of (5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoate (CHEBI:137546)
Incoming Relation(s)
(5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoate (CHEBI:137546) is conjugate base of (5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid (CHEBI:138325)
IUPAC Name 
(5S,6E,8Z,11Z,13E,15S)-15-hydroperoxy-5-hydroxyicosa-6,8,11,13-tetraenoic acid
Synonyms  Source
-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-eicosatetraenoic acidChEBI
(5S,6E,8Z,11Z,13E,15S)-15-hydroperoxy-5-hydroxyicosatetraenoic acidChEBI
5(S)-H-15(S)-HPETEChEBI
Citations