CHEBI:137320 - (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate

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ChEBI Name (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate
ChEBI ID CHEBI:137320
ChEBI ASCII Name (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate
Definition A 13-hydroxy-14,15-epoxy-(5Z,8Z,11Z)-icosatrienoate that is the conjugate base of 13(S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C20H31O4
Net Charge -1
Average Mass 335.459
Monoisotopic Mass 335.22278
InChI InChI=1S/C20H32O4/c1-2-3-11-15-18-20(24-18)17(21)14-12-9-7-5-4-6-8-10-13-16-19(22)23/h5-8,12,14,17-18,20-21H,2-4,9-11,13,15-16H2,1H3,(H,22,23)/p-1/b7-5-,8-6-,14-12-/t17-,18-,20-/m0/s1
InChIKey FMRVHRPEVIVXKX-SRWZPIOTSA-M
SMILES O=C(CCC/C=C\C/C=C\C/C=C\[C@@H]([C@H]1[C@H](CCCCC)O1)O)[O-]
ChEBI Ontology
Outgoing (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate (CHEBI:137320) is a 13-hydroxy-14,15-epoxy-(5Z,8Z,11Z)-icosatrienoate (CHEBI:137342)
(13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate (CHEBI:137320) is conjugate base of (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoic acid (CHEBI:138135)
Incoming (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoic acid (CHEBI:138135) is conjugate acid of (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate (CHEBI:137320)
IUPAC Name
(5Z,8Z,11Z,13S)-13-hydroxy-13-[(2S,3S)-3-pentyloxiran-2-yl]trideca-5,8,11-trienoate
Synonyms Sources
(13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-eicosatrienoate UniProt
13-H-14,15-EETA(1−) SUBMITTER
Citations Waiting for Citations Types Sources
19737933 PubMed citation SUBMITTER
8555216 PubMed citation SUBMITTER
Last Modified
10 August 2017