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(Q115966034)
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English
7-[3-(3-Hydroxyoct-1-en-1-yl)-2,6-dioxabicyclo[3.1.1]heptan-4-yl]hept-5-enoic acid (non-preferred name)
group of stereoisomers with the chemical formula C₂₀H₃₂O₅
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
352.224974124
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₂O₅
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canonical SMILES
O=C(O)CCCC=CCC1C(OC2OC1C2)C=CC(O)CCCCC
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found in taxon
Homo sapiens
1 reference
stated in
A community-driven global reconstruction of human metabolism.
Identifiers
InChI
InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18-14-20(24-17)25-18)10-7-4-5-8-11-19(22)23/h4,7,12-13,15-18,20-21H,2-3,5-6,8-11,14H2,1H3,(H,22,23)
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InChIKey
DSNBHJFQCNUKMA-UHFFFAOYSA-N
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PubChem CID
213
1 reference
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
UniChem compound ID
49287173
1 reference
stated in
UniChem
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