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(Q104920122)
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English
(3,10,10-Trimethyl-7-methylidenecycloundeca-3,8-dien-1-yl) 4-hydroxybenzoate
group of stereoisomers with the chemical formula C₂₂H₂₈O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
humulane-type sesquiterpenoid
1 reference
inferred from
humulane-type sesquiterpenoid
mass
340.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₈O₃
0 references
canonical SMILES
O=C(OC1CC(=CCCC(=C)C=CC(C)(C)C1)C)C2=CC=C(O)C=C2
0 references
found in taxon
Ferula ceratophylla
2 references
stated in
The structures of ferocin and ferocinin
stated in
Esters of Ferula ceratophylla
Ferula subtilis
1 reference
stated in
Esters ofFerula soongarcia andFerulia subtilis
Ferula tatarica
1 reference
stated in
Esters ofFerula tatarica
Ferula juniperina
1 reference
stated in
Esters of Ferula ceratophylla
Identifiers
InChI
InChI=1S/C22H28O3/c1-16-6-5-7-17(2)14-20(15-22(3,4)13-12-16)25-21(24)18-8-10-19(23)11-9-18/h7-13,20,23H,1,5-6,14-15H2,2-4H3
0 references
InChIKey
AWLPVLIAJCOYIW-UHFFFAOYSA-N
0 references
PubChem CID
24126834
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
AWLPVLIAJCOYIW-UHFFFAOYSA-N
UniChem compound ID
58959902
1 reference
stated in
UniChem
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