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(Q104253581)
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English
Abietinic acid
group of stereoisomers with the chemical formula C₂₀H₃₀O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
abietane diterpenoid
1 reference
inferred from
abietane diterpenoid
mass
302.2245802
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₀O₂
0 references
canonical SMILES
O=C(O)C1(C)CCCC2(C)C3C(C=C(CC3)C(C)C)=CCC12
0 references
isomeric SMILES
CC(C)C1=CC2=CCC3C(C)(CCC[C@@]3(C)C(=O)O)C2CC1
0 references
found in taxon
Pinus pumila
1 reference
stated in
Terpenoids of the oleoresin of Pinus pumila
Larix gmelinii var. gmelinii
1 reference
stated in
Terpenoids of the oleoresin of the larch growing in Kamchatka
Identifiers
InChI
InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16?,17?,19?,20-/m1/s1
0 references
InChIKey
RSWGJHLUYNHPMX-OZNCTZQZSA-N
0 references
PubChem CID
60074028
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
29512929
1 reference
stated in
UniChem
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