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(Q104944977)
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English
(5,13-Dihydroxy-2,6,10-trimethyl-11-oxo-8-oxatetracyclo[7.3.1.01,5.06,10]tridecan-9-yl) benzoate
group of stereoisomers with the chemical formula C₂₂H₂₆O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
386.172938552
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₆O₆
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canonical SMILES
O=C(OC12OCC3(C)C4(O)CCC(C)C4(CC(=O)C13C)C2O)C=5C=CC=CC5
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found in taxon
Illicium difengpi
1 reference
stated in
Three new sesquiterpene lactones from the pericarps of Illicium merrillianum
Illicium verum
1 reference
stated in
Three new sesquiterpene lactones from the pericarps of Illicium merrillianum
Identifiers
InChI
InChI=1S/C22H26O6/c1-13-9-10-21(26)18(2)12-27-22(28-16(24)14-7-5-4-6-8-14)17(25)20(13,21)11-15(23)19(18,22)3/h4-8,13,17,25-26H,9-12H2,1-3H3
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InChIKey
BRRTVYWNYBLCAX-UHFFFAOYSA-N
0 references
PubChem CID
73313396
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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