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(Q104968559)
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English
(3,4,6-Trihydroxy-4,5,11-trimethyl-9-oxo-8-oxatricyclo[5.3.2.01,6]dodecan-5-yl)methyl benzoate
group of stereoisomers with the chemical formula C₂₂H₂₈O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
404.4544
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₈O₇
0 references
canonical SMILES
O=C(OCC1(C)C(O)(C)C(O)CC23CC(=O)OC(CC2C)C13O)C=4C=CC=CC4
0 references
found in taxon
Illicium dunnianum
2 references
stated in
Revision of the Structure of Dunnianin and Related Sesquiterpene Lactones fromIlliciumSpecies
stated in
Pseudoanisatin-like sesquiterpene lactones from the pericarps of Illicium dunnianum
Illicium floridanum
1 reference
stated in
Two sesquiterpene lactones from Illicium anisatum
Identifiers
InChI
InChI=1S/C22H28O7/c1-13-9-16-22(27)19(2,12-28-18(25)14-7-5-4-6-8-14)20(3,26)15(23)10-21(13,22)11-17(24)29-16/h4-8,13,15-16,23,26-27H,9-12H2,1-3H3
0 references
InChIKey
CRIUJHLQSLFERL-UHFFFAOYSA-N
0 references
PubChem CID
74007462
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CRIUJHLQSLFERL-UHFFFAOYSA-N
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