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(Q105380509)
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English
(3S,4'R)-4',5,6,6-tetramethylspiro[8,9-dihydro-7H-benzo[g][2]benzofuran-3,2'-oxolane]-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(3S)-4',5,6,6-tetramethyl-8,9-dihydro-7H-spiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one
1 reference
based on heuristic
inferred from SMILES
4',5,6,6-tetramethylspiro[8,9-dihydro-7H-benzo[g][2]benzofuran-3,2'-oxolane]-1-one
1 reference
based on heuristic
inferred from SMILES
mass
300.172544628
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3R,4'R)-4',5,6,6-tetramethylspiro[8,9-dihydro-7H-benzo[g][2]benzofuran-3,2'-oxolane]-1-one
1 reference
based on heuristic
inferred from InChI
(3S,4'S)-4',5,6,6-tetramethylspiro[8,9-dihydro-7H-benzo[g][2]benzofuran-3,2'-oxolane]-1-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₄O₃
0 references
canonical SMILES
O=C1OC2(OCC(C)C2)C3=CC(=C4C(=C13)CCCC4(C)C)C
0 references
isomeric SMILES
Cc1cc2c(c3c1C(C)(C)CCC3)C(=O)O[C@@]21C[C@@H](C)CO1
0 references
found in taxon
Salvia aegyptiaca
2 references
stated in
6-Methylcryptoacetalide, 6-methyl-epicryptoacetalide and 6-methylcryptotanshinone from Salvia aegyptiaca
stated in
6-Methylcryptoacetalide, 6-methyl-epicryptoacetalide and 6-methylcryptotanshinone from Salvia aegyptiaca
Identifiers
InChI
InChI=1S/C19H24O3/c1-11-9-19(21-10-11)14-8-12(2)16-13(15(14)17(20)22-19)6-5-7-18(16,3)4/h8,11H,5-7,9-10H2,1-4H3/t11-,19+/m1/s1
0 references
InChIKey
ZOIFYOGQGNHQEI-WYRIXSBYSA-N
0 references
PubChem CID
162966636
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZOIFYOGQGNHQEI-WYRIXSBYSA-N
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