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(Q105284857)
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English
Atlantolone
chemical compound
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No label defined
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Statements
instance of
type of chemical entity
0 references
subclass of
bisabolanes
0 references
mass
236.177630008
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(E)-6-hydroxy-6-methyl-2-[(1R)-4-methylcyclohex-3-en-1-yl]hept-2-en-4-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄O₂
0 references
canonical SMILES
O=C(C=C(C)C1CC=C(C)CC1)CC(O)(C)C
0 references
isomeric SMILES
CC1=CC[C@H](/C(C)=C\C(=O)CC(C)(C)O)CC1
0 references
found in taxon
Pseudotsuga sinensis var. sinensis
1 reference
stated in
Terpenoids and flavonoids from Pseudotsuga wilsoniana
Identifiers
InChI
InChI=1S/C15H24O2/c1-11-5-7-13(8-6-11)12(2)9-14(16)10-15(3,4)17/h5,9,13,17H,6-8,10H2,1-4H3/b12-9-/t13-/m0/s1
0 references
InChIKey
VETWBGGPKLAQQE-SUIFULHWSA-N
0 references
PubChem CID
101949827
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VETWBGGPKLAQQE-SUIFULHWSA-N
UniChem compound ID
97548492
1 reference
stated in
UniChem
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