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(Q104932666)
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English
(3S,3aS,6E,10Z,11aR)-10-(hydroxymethyl)-3-methyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-6-carbaldehyde
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
10-(hydroxymethyl)-3-methyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-6-carbaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
264.13615912
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3S,3aS,6E,10Z,11aS)-10-(hydroxymethyl)-3-methyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-6-carbaldehyde
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₄
0 references
canonical SMILES
O=CC1=CCCC(=CC2OC(=O)C(C)C2CC1)CO
0 references
isomeric SMILES
C[C@@H]1C(=O)O[C@H]2/C=C(\CO)CC/C=C(/C=O)CC[C@@H]12
0 references
found in taxon
Ixeris tamagawaensis
2 references
stated in
Sesquiterpene lactones from Ixeris tamagawaensis Kitam.
stated in
Sesquiterpene lactones from Ixeris tamagawaensis Kitam. III.
Identifiers
InChI
InChI=1S/C15H20O4/c1-10-13-6-5-11(8-16)3-2-4-12(9-17)7-14(13)19-15(10)18/h3,7-8,10,13-14,17H,2,4-6,9H2,1H3/b11-3+,12-7-/t10-,13-,14-/m0/s1
0 references
InChIKey
BECWIFDDQFURDK-XVEDKWIJSA-N
0 references
PubChem CID
162940281
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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