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(Q105232417)
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English
[8-[(4-Hydroxy-6-methyl-2-oxopyran-3-yl)methyl]-1,1,4a,8a-tetramethyl-7-methylidene-2,3,4,4b,5,6,8,9,10,10a-decahydrophenanthren-2-yl] acetate
group of stereoisomers with the chemical formula C₂₈H₄₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
isocopalane diterpenoid
1 reference
inferred from
isocopalane diterpenoid
mass
456.28757437999985
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₄₀O₅
0 references
canonical SMILES
O=C1OC(=CC(O)=C1CC2C(=C)CCC3C2(C)CCC4C(C)(C)C(OC(=O)C)CCC43C)C
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Identifiers
InChI
InChI=1S/C28H40O5/c1-16-8-9-23-27(6,20(16)15-19-21(30)14-17(2)32-25(19)31)12-10-22-26(4,5)24(33-18(3)29)11-13-28(22,23)7/h14,20,22-24,30H,1,8-13,15H2,2-7H3
0 references
InChIKey
QZWJQNIIRYNONX-UHFFFAOYSA-N
0 references
PubChem CID
163088791
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QZWJQNIIRYNONX-UHFFFAOYSA-N
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