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(Q104938849)
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English
3-[3-(4-Acetyloxy-3,7-dimethylocta-2,6-dienyl)-4-methoxyphenyl]prop-2-enoic acid
group of stereoisomers with the chemical formula C₂₂H₂₈O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
2,6-dimethyloctane monoterpenoid
1 reference
inferred from
2,6-dimethyloctane monoterpenoid
biogenic alkylphenol
1 reference
inferred from
biogenic alkylphenol
mass
372.19367399599986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₈O₅
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canonical SMILES
O=C(O)C=CC1=CC=C(OC)C(=C1)CC=C(C)C(OC(=O)C)CC=C(C)C
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Identifiers
InChI
InChI=1S/C22H28O5/c1-15(2)6-11-20(27-17(4)23)16(3)7-10-19-14-18(9-13-22(24)25)8-12-21(19)26-5/h6-9,12-14,20H,10-11H2,1-5H3,(H,24,25)
0 references
InChIKey
BNKBJTGWXDOAKC-UHFFFAOYSA-N
0 references
PubChem CID
162936680
1 reference
based on heuristic
inferred from InChIKey
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