(12E,15S,18S)-15-Hydroxy-18-bromo-12,16,17-octadecatrienoic acid (CHEBI:200115)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(12E,15S,18S)-15-Hydroxy-18-bromo-12,16,17-octadecatrienoic acid

ChEBI ID	CHEBI:200115

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

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Download	Molfile XML SDF

Formula

C18H29BrO3

Net Charge

Average Mass

373.331

Monoisotopic Mass

372.13001

InChI

InChI=1S/C18H29BrO3/c19-16-12-14-17(20)13-10-8-6-4-2-1-3-5-7-9-11-15-18(21)22/h8,10,14,16-17,20H,1-7,9,11,13,15H2,(H,21,22)/b10-8-/t12?,17-/m0/s1

InChIKey

RBYYPRIJRZKHRI-AOVWDFDISA-N

SMILES

BrC=C=C[C@@H](O)C/C=C\CCCCCCCCCCC(=O)O

Metabolite of Species	Details
Acarospora (NCBI:txid88747)	See: DOI

ChEBI Ontology
Outgoing	(12E,15S,18S)-15-Hydroxy-18-bromo-12,16,17-octadecatrienoic acid (CHEBI:200115) is a lipid (CHEBI:18059)