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(Q105260014)
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English
2-(2-Formyl-1,3,3-trimethylcyclohexyl)-4-methoxy-5-propan-2-ylbenzaldehyde
group of stereoisomers with the chemical formula C₂₁H₃₀O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
6,7-secoabietane diterpenoid
1 reference
inferred from
6,7-secoabietane diterpenoid
mass
330.4619
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₀O₃
0 references
canonical SMILES
O=CC1=CC(=C(OC)C=C1C2(C)CCCC(C)(C)C2C=O)C(C)C
0 references
Identifiers
InChI
InChI=1S/C21H30O3/c1-14(2)16-10-15(12-22)17(11-18(16)24-6)21(5)9-7-8-20(3,4)19(21)13-23/h10-14,19H,7-9H2,1-6H3
0 references
InChIKey
SSXHPHMXIMAVBZ-UHFFFAOYSA-N
0 references
PubChem CID
162875318
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SSXHPHMXIMAVBZ-UHFFFAOYSA-N
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