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(Q104933531)
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English
(1alpha,2Z,7Z,10R,11alpha)-8,12,12-Trimethyl-10beta-acetoxybicyclo[9.1.0]dodeca-2,7-diene-4-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(4,12,12-Trimethyl-8-oxo-2-bicyclo[9.1.0]dodeca-4,9-dienyl) acetate
1 reference
based on heuristic
inferred from SMILES
mass
276.172544628
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₄O₃
0 references
canonical SMILES
O=C(OC1CC(=CCCC(=O)C=CC2C1C2(C)C)C)C
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isomeric SMILES
CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C
0 references
found in taxon
Valeriana fauriei
1 reference
stated in
Iridoids and sesquiterpenoids with NGF-potentiating activity from the rhizomes and roots of Valeriana fauriei
Valeriana officinalis
1 reference
stated in
Iridoids and sesquiterpenoids with NGF-potentiating activity from the rhizomes and roots of Valeriana fauriei
Identifiers
InChI
InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1
0 references
InChIKey
BESWSXOVDJDSKQ-HUJQHWLQSA-N
0 references
PubChem CID
11630488
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BESWSXOVDJDSKQ-HUJQHWLQSA-N
UniChem compound ID
32747554
1 reference
stated in
UniChem
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