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English
[(1R)-5-formyl-2,6,6-trimethylcyclohexa-2,4-dien-1-yl] (E)-4-acetyloxy-3-methylbut-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(5-Formyl-2,6,6-trimethylcyclohexa-2,4-dien-1-yl) 4-acetyloxy-3-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
mass
306.146723804
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₂O₅
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canonical SMILES
O=CC1=CC=C(C)C(OC(=O)C=C(C)COC(=O)C)C1(C)C
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isomeric SMILES
CC(=O)OC/C(C)=C/C(=O)O[C@@H]1C(C)=CC=C(C=O)C1(C)C
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found in taxon
Dichoropetalum carvifolia
1 reference
stated in
Constituents of Umbelliferous Plants. XVI. Terpenoids from the Root of Selinum carvifolium L..
Carum carvi
1 reference
stated in
Constituents of Umbelliferous Plants. XVI. Terpenoids from the Root of Selinum carvifolium L..
Identifiers
InChI
InChI=1S/C17H22O5/c1-11(10-21-13(3)19)8-15(20)22-16-12(2)6-7-14(9-18)17(16,4)5/h6-9,16H,10H2,1-5H3/b11-8+/t16-/m1/s1
0 references
InChIKey
UGWAKJANSZEVRT-YCABEKBOSA-N
0 references
PubChem CID
163034839
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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