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(Q105384126)
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English
[(1S,2S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] (Z)-2-methylbut-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(2Z)-2-Methyl-2-butenoic acid 2-bornyl ester
1 reference
based on heuristic
inferred from SMILES
(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl) 2-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
mass
236.177630008
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
bornyl angelate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄O₂
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canonical SMILES
O=C(OC1CC2CCC1(C)C2(C)C)C(=CC)C
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isomeric SMILES
C/C=C(/C)C(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
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found in taxon
Tanacetum parthenium
1 reference
stated in
Sesquiterpene lactones and other constituents from Tanacetum parthenium
Identifiers
InChI
InChI=1S/C15H24O2/c1-6-10(2)13(16)17-12-9-11-7-8-15(12,5)14(11,3)4/h6,11-12H,7-9H2,1-5H3/b10-6-/t11-,12-,15+/m0/s1
0 references
InChIKey
ZUVAGNOBOHVXJJ-AJXDGQIOSA-N
0 references
PubChem CID
162901484
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZUVAGNOBOHVXJJ-AJXDGQIOSA-N
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