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(Q105035390)
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English
(1R,6R)-1-[(S)-3-Hydroxybutyl]-2,2-dimethyl-7-oxaspiro[5.2]octane-4-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-(3-Hydroxybutyl)-5,5-dimethyl-1-oxaspiro[2.5]octan-7-one
1 reference
based on heuristic
inferred from SMILES
mass
226.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₂O₃
0 references
canonical SMILES
O=C1CC2(OC2)C(CCC(O)C)C(C)(C)C1
0 references
isomeric SMILES
C[C@H](O)CC[C@@H]1C(C)(C)CC(=O)C[C@]12CO2
0 references
found in taxon
common sunflower
3 references
stated in
Bioactive terpenoids from sunflower leaves cv. Peredovick®
stated in
Bioactive apocarotenoids annuionones F and G: structural revision of annuionones A, B and E
stated in
Bioactive flavonoids from Helianthus annuus cultivars
Macaranga tanarius
1 reference
stated in
Constituents of the leaves of Macaranga tanarius
Identifiers
InChI
InChI=1S/C13H22O3/c1-9(14)4-5-11-12(2,3)6-10(15)7-13(11)8-16-13/h9,11,14H,4-8H2,1-3H3/t9-,11+,13-/m0/s1
0 references
InChIKey
HYNHXOXLUXVTRM-NDMJEZRESA-N
0 references
PubChem CID
5319213
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
33702791
1 reference
stated in
UniChem
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