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(Q105132251)
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English
[2-(3-Hydroxy-3-methylbut-1-enyl)-4-(3-methoxy-3-oxoprop-1-enyl)phenyl] 3-acetyloxybutanoate
group of stereoisomers with the chemical formula C₂₁H₂₆O₇
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
390.1678531719998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₆O₇
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canonical SMILES
O=C(OC)C=CC1=CC=C(OC(=O)CC(OC(=O)C)C)C(C=CC(O)(C)C)=C1
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Identifiers
InChI
InChI=1S/C21H26O7/c1-14(27-15(2)22)12-20(24)28-18-8-6-16(7-9-19(23)26-5)13-17(18)10-11-21(3,4)25/h6-11,13-14,25H,12H2,1-5H3
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InChIKey
JOCMICFBSDGOAQ-UHFFFAOYSA-N
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PubChem CID
163043455
1 reference
based on heuristic
inferred from InChIKey
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