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(Q105273007)
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English
(3aS,5aR,9aR,9bR)-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one
1 reference
based on heuristic
inferred from SMILES
mass
232.14632988
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
alpha-Cyclocostunolide
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R)-alpha-Methylene-1alpha-hydroxy-4abeta,8-dimethyl-1,2,3,4,4a,5,6,8aalpha-octahydronaphthalene-2alpha-acetic acid lactone
1 reference
based on heuristic
inferred from InChI
cyclocostunolide
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₂
0 references
canonical SMILES
O=C1OC2C(C1=C)CCC3(C)CCC=C(C)C23
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2[C@H]1CC[C@@]1(C)CCC=C(C)[C@H]21
0 references
found in taxon
Bidens subalternans
1 reference
stated in
Eudesmane sesquiterpenes from Eupatorium Quadrangulare
Critonia quadrangularis
1 reference
stated in
Eudesmane sesquiterpenes from Eupatorium Quadrangulare
Identifiers
InChI
InChI=1S/C15H20O2/c1-9-5-4-7-15(3)8-6-11-10(2)14(16)17-13(11)12(9)15/h5,11-13H,2,4,6-8H2,1,3H3/t11-,12+,13+,15+/m0/s1
0 references
InChIKey
UHODXTMZSDNATP-KYEXWDHISA-N
0 references
PubChem CID
163083566
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UHODXTMZSDNATP-KYEXWDHISA-N
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