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(Q50318237)
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English
(11R,12E,14Z)-11-hydroxyicosa-12,14-dienoic acid
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
icosanoid
0 references
mass
324.26644501199996
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(11S,12E,14Z)-11-hydroxyicosa-12,14-dienoic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₆O₃
0 references
canonical SMILES
CCCCCC=CC=CC(O)CCCCCCCCCC(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCC/C=C\C=C\[C@@H](CCCCCCCCCC(=O)O)O
0 references
Identifiers
InChI
InChI=1S/C20H36O3/c1-2-3-4-5-7-10-13-16-19(21)17-14-11-8-6-9-12-15-18-20(22)23/h7,10,13,16,19,21H,2-6,8-9,11-12,14-15,17-18H2,1H3,(H,22,23)/b10-7-,16-13+/t19-/m0/s1
0 references
InChIKey
HDMIRVFIVOGVIC-VOYJXKAKSA-N
0 references
PubChem CID
16061090
1 reference
matched by identifier from
InChIKey
InChIKey
HDMIRVFIVOGVIC-VOYJXKAKSA-N
ChEBI ID
165294
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H36O3/c1-2-3-4-5-7-10-13-16-19(21)17-14-11-8-6-9-12-15-18-20(22)23/h7,10,13,16,19,21H,2-6,8-9,11-12,14-15,17-18H2,1H3,(H,22,23)/b10-7-,16-13+/t19-/m0/s1
UniChem compound ID
50127519
1 reference
stated in
UniChem
Probes And Drugs ID
PD020962
0 references
LIPID MAPS ID
LMFA03000005
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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