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(Q105030204)
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MandolinW
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
10-Hydroxy-7,11-dimethylbicyclo[9.1.0]dodeca-2,6-diene-3-carbaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
234.161979944
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,2E,6E,10S,11S)-10-hydroxy-7,11-dimethylbicyclo[9.1.0]dodeca-2,6-diene-3-carbaldehyde
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,2Z,6E,10S,11S)-10-hydroxy-7,11-dimethylbicyclo[9.1.0]dodeca-2,6-diene-3-carbaldehyde
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₂
0 references
canonical SMILES
O=CC1=CC2CC2(C)C(O)CCC(=CCC1)C
0 references
isomeric SMILES
C/C1=C/CC/C(C=O)=C\[C@H]2C[C@]2(C)[C@@H](O)CC1
0 references
found in taxon
Aristolochia mollissima
1 reference
stated in
Constituents of the roots and stems of Aristolochia mollissima
Guatteria guianensis
1 reference
stated in
New sesquiterpenoids from the root of Guatteria multivenia
Guatteria multivenia
1 reference
stated in
New sesquiterpenoids from the root of Guatteria multivenia
Identifiers
InChI
InChI=1S/C15H22O2/c1-11-4-3-5-12(10-16)8-13-9-15(13,2)14(17)7-6-11/h4,8,10,13-14,17H,3,5-7,9H2,1-2H3/b11-4-,12-8+/t13-,14-,15-/m0/s1
0 references
InChIKey
HLMCIXCJYXTZPQ-QAURWTMSSA-N
0 references
PubChem CID
101093875
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HLMCIXCJYXTZPQ-QAURWTMSSA-N
UniChem compound ID
97437160
1 reference
stated in
UniChem
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