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(Q113947728)
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English
(5Z,8Z,11E,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
318.21949481999997
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
18S-HEPE
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
18R-HEPE
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₀O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCC(O)C=CC=CCC=CCC=CCC=CCCCC(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC[C@@H](/C=C/C=C\C/C=C/C/C=C\C/C=C\CCCC(=O)O)O
1 reference
based on heuristic
inferred from SMILES
Identifiers
InChI
InChI=1S/C20H30O3/c1-2-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)23/h4-7,10-13,15,17,19,21H,2-3,8-9,14,16,18H2,1H3,(H,22,23)/b6-4-,7-5+,12-10-,13-11-,17-15+/t19-/m0/s1
1 reference
based on heuristic
inferred from SMILES
InChIKey
LRWYBGFSVUBWMO-NQZHIPPKSA-N
0 references
PubChem CID
53481496
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LRWYBGFSVUBWMO-NQZHIPPKSA-N
UniChem compound ID
31993847
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0012611
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LRWYBGFSVUBWMO-NQZHIPPKSA-N
LIPID MAPS ID
LMFA03070054
0 references
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