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(Q105234696)
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English
7-isopropyl-1,4a-dimethyl-5,8-dioxo-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid
group of stereoisomers with the chemical formula C₂₀H₂₆O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
abietane diterpenoid
1 reference
inferred from
abietane diterpenoid
mass
330.4188
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₆O₄
0 references
canonical SMILES
O=C1C=C(C(=O)C2=C1C3(C)CCCC(C(=O)O)(C)C3CC2)C(C)C
0 references
Identifiers
InChI
InChI=1S/C20H26O4/c1-11(2)13-10-14(21)16-12(17(13)22)6-7-15-19(16,3)8-5-9-20(15,4)18(23)24/h10-11,15H,5-9H2,1-4H3,(H,23,24)
0 references
InChIKey
REEKIKKEQHNJQO-UHFFFAOYSA-N
0 references
PubChem CID
3979711
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
REEKIKKEQHNJQO-UHFFFAOYSA-N
UniChem compound ID
31132005
1 reference
stated in
UniChem
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