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(Q105257483)
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English
(4aR,8R)-4a,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4a,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-one
1 reference
based on heuristic
inferred from SMILES
mass
176.120115132
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₆O
0 references
canonical SMILES
O=C1C=CC2(C(=C1)C(C)CCC2)C
0 references
isomeric SMILES
C[C@@H]1CCC[C@]2(C)C=CC(=O)C=C12
0 references
found in taxon
Litophyton erectum
1 reference
stated in
Revision of the absolute configuration at C(23) of lanostanoids and isolation of secondary metabolites from formosan soft coral Nephthea erecta.
Nephthea erecta
1 reference
stated in
Revision of the absolute configuration at C(23) of lanostanoids and isolation of secondary metabolites from formosan soft coral Nephthea erecta.
Identifiers
InChI
InChI=1S/C12H16O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h5,7-9H,3-4,6H2,1-2H3/t9-,12-/m1/s1
0 references
InChIKey
SPNLYFPIWOEXSG-BXKDBHETSA-N
0 references
PubChem CID
22790670
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
25052875
1 reference
stated in
UniChem
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