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(Q104920464)
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English
methyl 8-[(1R,5S)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Methyl 8-(4-oxo-5-pent-2-enylcyclopent-2-en-1-yl)octanoate
1 reference
based on heuristic
inferred from SMILES
mass
306.21949482
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
methyl 8-[(1R,5R)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₃₀O₃
0 references
canonical SMILES
O=C(OC)CCCCCCCC1C=CC(=O)C1CC=CCC
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isomeric SMILES
CC/C=C\C[C@@H]1C(=O)C=C[C@H]1CCCCCCCC(=O)OC
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found in taxon
Chromolaena connivens
1 reference
stated in
Ent-Clerodane derivatives from Chromolaena connivens
Chromolaena morii
1 reference
stated in
Further prostaglandin-like fatty acids from Chromolaena morii
Identifiers
InChI
InChI=1S/C19H30O3/c1-3-4-8-12-17-16(14-15-18(17)20)11-9-6-5-7-10-13-19(21)22-2/h4,8,14-17H,3,5-7,9-13H2,1-2H3/b8-4-/t16-,17+/m1/s1
0 references
InChIKey
AXDNONFPXLVMOY-YFKBFVAJSA-N
0 references
PubChem CID
14037068
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AXDNONFPXLVMOY-YFKBFVAJSA-N
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