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(Q105141088)
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English
5-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid
group of stereoisomers with the chemical formula C₂₀H₃₆O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
labdanes
1 reference
inferred from
labdanes
mass
324.266445012
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₆O₃
0 references
canonical SMILES
O=C(O)CC(C)CCC1C(O)(C)CCC2C(C)(C)CCCC12C
0 references
found in taxon
Ageratina
1 reference
stated in
Absolute configuration of (13R)- and (13S)-labdane diterpenes coexisting in Ageratina jocotepecana
Identifiers
InChI
InChI=1S/C20H36O3/c1-14(13-17(21)22)7-8-16-19(4)11-6-10-18(2,3)15(19)9-12-20(16,5)23/h14-16,23H,6-13H2,1-5H3,(H,21,22)
0 references
InChIKey
KHCCSRVJJDOANA-UHFFFAOYSA-N
0 references
PubChem CID
3430304
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
55945880
1 reference
stated in
UniChem
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