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(Q104916344)
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English
CID 163097015
group of stereoisomers with the chemical formula C₂₀H₂₆O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
labdanes
1 reference
inferred from
labdanes
mass
346.178023932
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₆O₅
0 references
canonical SMILES
O=C1OC2CC(C)C3(OC4(C=COC4)CC3)C5(C)CCC(=O)C1(C)C25
0 references
found in taxon
Marrubium thessalum
1 reference
stated in
Preperegrinine, a prefuranic labdane diterpene from Marrubium friwaldskyanum
Marrubium friwaldskyanum
1 reference
stated in
Labdane diterpenes from Marrubium thessalum
Identifiers
InChI
InChI=1S/C20H26O5/c1-12-10-13-15-17(2,5-4-14(21)18(15,3)16(22)24-13)20(12)7-6-19(25-20)8-9-23-11-19/h8-9,12-13,15H,4-7,10-11H2,1-3H3
0 references
InChIKey
APJLGTWXFWPNFV-UHFFFAOYSA-N
0 references
PubChem CID
163097015
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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