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(Q105303640)
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English
(1R)-2-Oxo-4-methoxy-5alpha-[(Z)-1-propenyl]-3-cyclopentene-1beta-acetic acid methyl ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Methyl 2-(3-methoxy-5-oxo-2-prop-1-enylcyclopent-3-en-1-yl)acetate
1 reference
based on heuristic
inferred from SMILES
methyl 2-{3-methoxy-5-oxo-2-[(1Z)-prop-1-en-1-yl]cyclopent-3-en-1-yl}acetate
1 reference
based on heuristic
inferred from SMILES
mass
224.104858992
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S)-2-Oxo-4-methoxy-5beta-[(Z)-1-propenyl]-3-cyclopentene-1alpha-acetic acid methyl ester
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₆O₄
0 references
canonical SMILES
O=C(OC)CC1C(=O)C=C(OC)C1C=CC
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isomeric SMILES
C/C=C\[C@H]1C(OC)=CC(=O)[C@@H]1CC(=O)OC
0 references
found in taxon
Philadelphia fleabane
1 reference
stated in
Two new cyclopentenone derivatives and a new cyclooctadienone derivative from Erigeron annuus (L.) PERS., Erigeron philadelphicus L., and Erigeron sumatrensis RETZ.
Identifiers
InChI
InChI=1S/C12H16O4/c1-4-5-8-9(6-12(14)16-3)10(13)7-11(8)15-2/h4-5,7-9H,6H2,1-3H3/b5-4-/t8-,9-/m1/s1
0 references
InChIKey
WEXBONOFEQOHQL-UVSMVFJQSA-N
0 references
PubChem CID
11085437
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
33432483
1 reference
stated in
UniChem
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