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(Q104385960)
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Zierone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3,8-dimethyl-4-(propan-2-ylidene)-1,2,6,7,8,8a-hexahydroazulen-5-one
1 reference
based on heuristic
inferred from SMILES
mass
218.167065324
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(8S,8Ar)-3,8-dimethyl-4-propan-2-ylidene-1,2,6,7,8,8a-hexahydroazulen-5-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Zierone(elleryone)
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O
0 references
canonical SMILES
O=C1C(C2=C(C)CCC2C(C)CC1)=C(C)C
0 references
isomeric SMILES
CC(C)=C1C(=O)CC[C@@H](C)[C@@H]2CCC(C)=C12
0 references
found in taxon
Zieria arborescens
1 reference
stated in
Essential oil constituents of the genus Zieria
Zieria laevigata
1 reference
stated in
Essential oil constituents of the genus Zieria
Zieria murphyi
1 reference
stated in
Essential oil constituents of the genus Zieria
Identifiers
InChI
InChI=1S/C15H22O/c1-9(2)14-13(16)8-6-10(3)12-7-5-11(4)15(12)14/h10,12H,5-8H2,1-4H3/t10-,12+/m1/s1
0 references
InChIKey
OONKKRRSPIDEBA-PWSUYJOCSA-N
0 references
PubChem CID
91752839
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OONKKRRSPIDEBA-PWSUYJOCSA-N
UniChem compound ID
100524981
1 reference
stated in
UniChem
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