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CHEBI:140290 - (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate

ChEBI IDCHEBI:140290
ChEBI Name(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate
Stars
ASCII Name(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate
DefinitionA (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoate in which the chiral centres at positions 16 and 17 both have S-configuration. An intermediate of specialised proresolving mediators
Last Modified28 February 2018
SubmitterSteve
DownloadsMolfile
FormulaC22H31O3
Net Charge-1
Average Mass343.487
Monoisotopic Mass343.22787
SMILESCC/C=C\C[C@@H]1O[C@H]1/C=C/C=C/C=C\C/C=C\CCCCCC(=O)[O-]
InChIInChI=1S/C22H32O3/c1-2-3-14-17-20-21(25-20)18-15-12-10-8-6-4-5-7-9-11-13-16-19-22(23)24/h3,5-8,10,12,14-15,18,20-21H,2,4,9,11,13,16-17,19H2,1H3,(H,23,24)/p-1/b7-5-,8-6-,12-10+,14-3-,18-15+/t20-,21-/m0/s1
InChIKeyAVAZFRKFZXNPMT-HWOJEQMHSA-M
ChEBI Ontology
Outgoing Relation(s)
(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate (CHEBI:140290) is a (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoate (CHEBI:133932)
(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate (CHEBI:140290) is conjugate base of (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoic acid (CHEBI:140224)
Incoming Relation(s)
(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoic acid (CHEBI:140224) is conjugate acid of (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate (CHEBI:140290)
IUPAC Name 
(7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoate
Synonyms  Source
16(S),17(S)-epoxy-DPA(n−3)(1−)ChEBI
(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosa-7,10,12,14,19-pentaenoateChEBI
16(S),17(S)-epoxy-ω−3-docosapentaenoateChEBI