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13-Hydroxy-9-oxoprost-14-yn-1-oic acid
group of stereoisomers with the chemical formula C₂₀H₃₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
336.23005950399994
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCC#CC(O)C1CCC(=O)C1CCCCCCC(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCCC#CC(O)[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H32O4/c1-2-3-4-5-9-12-18(21)17-14-15-19(22)16(17)11-8-6-7-10-13-20(23)24/h16-18,21H,2-8,10-11,13-15H2,1H3,(H,23,24)/t16-,17+,18?/m1/s1
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InChIKey
YPSYXYVPLKXAIE-DVKDBIPTSA-N
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CAS Registry Number
57755-78-9
0 references
PubChem CID
191460
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
60390241
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60973342
0 references
DSSTOX compound identifier
DTXCID301400795
0 references
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