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(Q105188762)
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English
(3aR,4aR,5S,9aR)-4a,5-dimethyl-3-methylidene-4,5,6,7,8,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(3aS,5S,9aR)-4a,5-dimethyl-3-methylidene-3aH,4H,5H,6H,7H,8H,9aH-naphtho[2,3-b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
4a,5-dimethyl-3-methylidene-4,5,6,7,8,9a-hexahydro-3aH-benzo[f][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
(3aS,4aR,5S,9aR)-4a,5-dimethyl-3-methylidene-4,5,6,7,8,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Eremofrullanolide
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₂
0 references
canonical SMILES
O=C1OC2C=C3CCCC(C)C3(C)CC2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2C=C3CCC[C@H](C)[C@@]3(C)C[C@H]12
0 references
found in taxon
Stevia polyphylla
1 reference
stated in
The first 12.8β-germacrolide and other constituents from bolivian Stevia species
Artemisia pectinata
1 reference
stated in
Co-occurrence of eremophilanes and eudesmanes in Artemisia pectinata
Stevia achalensis
1 reference
stated in
Neue Sesquiterpenlactone und andere Inhaltsstoffe ausStevia mercedensis undStevia achalensis
Neopallasia pectinata
1 reference
stated in
Co-occurrence of eremophilanes and eudesmanes in Artemisia pectinata
Identifiers
InChI
InChI=1S/C15H20O2/c1-9-5-4-6-11-7-13-12(8-15(9,11)3)10(2)14(16)17-13/h7,9,12-13H,2,4-6,8H2,1,3H3/t9-,12+,13+,15+/m0/s1
0 references
InChIKey
OAPAQBTVYKCGMG-XRFFLINXSA-N
0 references
PubChem CID
162961222
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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