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(Q104953862)
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English
(4aS,8aR,9aR)-9a-ethoxy-4,4,7-trimethyl-5,6,8a,9-tetrahydro-4aH-benzo[f][1]benzofuran-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
9a-ethoxy-4,4,7-trimethyl-5,6,8a,9-tetrahydro-4aH-benzo[f][1]benzofuran-2-one
1 reference
based on heuristic
inferred from SMILES
mass
276.172544628
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(4aR,8aS,9aS)-9a-ethoxy-4,4,7-trimethyl-5,6,8a,9-tetrahydro-4aH-benzo[f][1]benzofuran-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₄O₃
0 references
canonical SMILES
O=C1OC2(OCC)C(=C1)C(C)(C)C3CCC(=CC3C2)C
0 references
isomeric SMILES
CCO[C@@]12C[C@@H]3C=C(C)CC[C@@H]3C(C)(C)C1=CC(=O)O2
0 references
found in taxon
Dysidea arenaria
1 reference
stated in
9-Hydroxyfurodysinin-O-ethyl lactone: a new sesquiterpene isolated from the tropical marine sponge Dysidea arenaria.
Identifiers
InChI
InChI=1S/C17H24O3/c1-5-19-17-10-12-8-11(2)6-7-13(12)16(3,4)14(17)9-15(18)20-17/h8-9,12-13H,5-7,10H2,1-4H3/t12-,13-,17+/m0/s1
0 references
InChIKey
CCVTVCOOGKIAQW-GDZNZVCISA-N
0 references
PubChem CID
163012144
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CCVTVCOOGKIAQW-GDZNZVCISA-N
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