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(Q105187856)
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English
[16-Acetyloxy-3,11-bis(acetyloxymethyl)-15-methyl-7-methylidene-6-oxohexadeca-2,10,14-trienyl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
biogenic acyclic ketone
0 references
phytane diterpenoid
0 references
mass
520.26723286
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₀O₉
0 references
canonical SMILES
O=C(OCC=C(COC(=O)C)CCC(=O)C(=C)CCC=C(COC(=O)C)CCC=C(C)COC(=O)C)C
0 references
found in taxon
Dendroviguiera sylvatica
1 reference
stated in
Heliangolides from Viguiera sylvatica
Identifiers
InChI
InChI=1S/C28H40O9/c1-20(17-35-23(4)30)9-7-11-26(18-36-24(5)31)12-8-10-21(2)28(33)14-13-27(19-37-25(6)32)15-16-34-22(3)29/h9,12,15H,2,7-8,10-11,13-14,16-19H2,1,3-6H3
0 references
InChIKey
NZDPEWQYQUYNOI-UHFFFAOYSA-N
0 references
PubChem CID
163006467
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NZDPEWQYQUYNOI-UHFFFAOYSA-N
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