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(Q113960127)
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English
methyl (4E)-3-(2-hydroxyethyl)-4-(hydroxymethyl)hex-4-enoate
group of stereoisomers with the chemical formula C₁₀H₁₈O₄
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
202.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₈O₄
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canonical SMILES
O=C(OC)CC(C(=CC)CO)CCO
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isomeric SMILES
C/C=C(/CO)C(CCO)CC(=O)OC
1 reference
based on heuristic
inferred from InChI
found in taxon
Syringa oblata
1 reference
stated in
Anti-inflammatory terpenoid derivatives from the twigs of Syringa oblata var. dilatata
Identifiers
InChI
InChI=1S/C10H18O4/c1-3-8(7-12)9(4-5-11)6-10(13)14-2/h3,9,11-12H,4-7H2,1-2H3/b8-3-
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InChIKey
SQTYTHDMMRNHEH-BAQGIRSFSA-N
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