15(S)-HPETE (CHEBI:15628)

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CHEBI:15628 - 15(S)-HPETE

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ChEBI ID	CHEBI:15628
ChEBI Name	15(S)-HPETE
Stars
ASCII Name	15(S)-HPETE
Definition	The (S)-enantiomer of 15-HPETE.
Secondary ChEBI IDs	CHEBI:758, CHEBI:10920, CHEBI:18594, CHEBI:18595, CHEBI:19152, CHEBI:36041
Last Modified	23 December 2018
Submitter	Marcus Ennis
Downloads	Molfile

Formula	C20H32O4
Net Charge	0
Average Mass	336.472
Monoisotopic Mass	336.23006
SMILES	CCCCC[C@@H](/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O)OO
InChI	InChI=1S/C20H32O4/c1-2-3-13-16-19(24-23)17-14-11-9-7-5-4-6-8-10-12-15-18-20(21)22/h4-5,8-11,14,17,19,23H,2-3,6-7,12-13,15-16,18H2,1H3,(H,21,22)/b5-4-,10-8-,11-9-,17-14+/t19-/m0/s1
InChIKey	BFWYTORDSFIVKP-VAEKSGALSA-N

Species of Metabolite	Component	Source	Comments
Mus musculus (ncbitaxon:10090)	-	PubMed (19425150)	Source: BioModels - MODEL1507180067

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 Roles:	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans.

ChEBI Ontology

Outgoing Relation(s)
	15(S)-HPETE (CHEBI:15628) has functional parent icosa-5,8,11,13-tetraenoic acid (CHEBI:36035)
	15(S)-HPETE (CHEBI:15628) has role mouse metabolite (CHEBI:75771)
	15(S)-HPETE (CHEBI:15628) is a 15-HPETE (CHEBI:91271)
	15(S)-HPETE (CHEBI:15628) is conjugate acid of 15(S)-HPETE(1−) (CHEBI:57446)
	15(S)-HPETE (CHEBI:15628) is enantiomer of 15(R)-HPETE (CHEBI:82627)
Incoming Relation(s)
	N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) has functional parent 15(S)-HPETE (CHEBI:15628)
	N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]alanine (CHEBI:132746) has functional parent 15(S)-HPETE (CHEBI:15628)
	N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]glycine (CHEBI:132738) has functional parent 15(S)-HPETE (CHEBI:15628)
	N-[15(S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]taurine (CHEBI:132508) has functional parent 15(S)-HPETE (CHEBI:15628)
	15(S)-HPETE 2-glyceryl ester (CHEBI:137187) has functional parent 15(S)-HPETE (CHEBI:15628)
	15(S)-HPETE(1−) (CHEBI:57446) is conjugate base of 15(S)-HPETE (CHEBI:15628)
	15(R)-HPETE (CHEBI:82627) is enantiomer of 15(S)-HPETE (CHEBI:15628)

IUPAC Name
(5Z,8Z,11Z,13E,15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoic acid

Synonyms	Source
15-Hydroperoxyeicosatetraenoate	KEGG COMPOUND
15-Hydroperoxyicosatetraenoate	KEGG COMPOUND
15-Hydroperoxyeicosatetraenoic acid	KEGG COMPOUND
15-Hydroperoxyicosatetraenoic acid	KEGG COMPOUND
(5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoate	KEGG COMPOUND
15(S)-HPETE	KEGG COMPOUND

Manual Xrefs	Databases
C05966	KEGG COMPOUND
LMFA03060014	LIPID MAPS
C00000400	KNApSAcK