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(Q105202059)
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English
ethyl (5S,6E,8Z,11Z,14Z)-5-hydroxyicosa-6,8,11,14-tetraenoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
ethyl (6E)-5-hydroxyicosa-6,8,11,14-tetraenoate
1 reference
based on heuristic
inferred from SMILES
mass
348.266445012
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₆O₃
0 references
canonical SMILES
O=C(OCC)CCCC(O)C=CC=CCC=CCC=CCCCCC
0 references
isomeric SMILES
CCCCC/C=C\C/C=C\C/C=C\C=C\[C@@H](O)CCCC(=O)OCC
0 references
found in taxon
Phymatolithon calcareum
1 reference
stated in
Novel Hydroxyicosatetraenoic and Hydroxyicosapentaenoic Acids and a 13-Oxo Analog. Isolation from a Mixture of the Calcareous Red AlgaeLithothamnion corallioides andLithothamnion calcareum of Brittany Waters
Lithothamnion corallioides
1 reference
stated in
Novel Hydroxyicosatetraenoic and Hydroxyicosapentaenoic Acids and a 13-Oxo Analog. Isolation from a Mixture of the Calcareous Red AlgaeLithothamnion corallioides andLithothamnion calcareum of Brittany Waters
Identifiers
InChI
InChI=1S/C22H36O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-21(23)19-17-20-22(24)25-4-2/h8-9,11-12,14-16,18,21,23H,3-7,10,13,17,19-20H2,1-2H3/b9-8-,12-11-,15-14-,18-16+/t21-/m1/s1
0 references
InChIKey
OWKGEPMKWDOLFO-XEGANCEHSA-N
0 references
PubChem CID
14775056
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OWKGEPMKWDOLFO-XEGANCEHSA-N
UniChem compound ID
63809766
1 reference
stated in
UniChem
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