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(Q105263130)
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English
(2beta,4beta,5alpha,5abeta)-4-(1,3-Benzodioxol-5-yl)-2,3,4,5-tetrahydro-7-methoxy-5-methyl-8H-2,5a-methano-1-benzoxepin-8-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1,10-Epoxy-4-methoxy-7-methyl-8-(3,4-methylenedioxyphenyl)-spiro(5,5)undeca-1,4-dien-3-one
1 reference
based on heuristic
inferred from SMILES
mass
340.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Futoenone
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₀O₅
0 references
canonical SMILES
O=C1C=C2OC3CC(C4=CC=C5OCOC5=C4)C(C)C2(C=C1OC)C3
0 references
isomeric SMILES
COC1=C[C@@]23C[C@@H](C[C@@H](c4ccc5c(c4)OCO5)[C@@H]2C)OC3=CC1=O
0 references
found in taxon
Magnolia denudata
1 reference
stated in
Hydroperoxysesquiterpene and lignan constituents of Magnolia kobus
Piper kadsura
1 reference
stated in
Anti-inflammatory neolignans from Piper kadsura
Identifiers
InChI
InChI=1S/C20H20O5/c1-11-14(12-3-4-16-17(5-12)24-10-23-16)6-13-8-20(11)9-18(22-2)15(21)7-19(20)25-13/h3-5,7,9,11,13-14H,6,8,10H2,1-2H3/t11-,13+,14+,20-/m0/s1
0 references
InChIKey
SXHVHWXETMBKPP-ZBQLUDKISA-N
0 references
PubChem CID
101820916
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
97514375
1 reference
stated in
UniChem
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