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CHEBI:165259 - 5R,6S-EpETrE

ChEBI IDCHEBI:165259
ChEBI Name5R,6S-EpETrE
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SubmitterMetaboLights
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FormulaC20H32O3
Net Charge0
Average Mass320.473
Monoisotopic Mass320.23514
SMILESCCCCC/C=C\C/C=C\C/C=C\C[C@@H]1O[C@@H]1CCCC(=O)O
InChIInChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-19(23-18)16-14-17-20(21)22/h6-7,9-10,12-13,18-19H,2-5,8,11,14-17H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-/t18-,19+/m0/s1
InChIKeyVBQNSZQZRAGRIX-SWFISBABSA-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)
5R,6S-EpETrE (CHEBI:165259) is a epoxy fatty acid (CHEBI:61498)
IUPAC Name 
4-[(2R,3S)-3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]oxiran-2-yl]butanoic acid
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