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(Q105005224)
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English
(3R,3aS,6E,10Z,11aR)-6,10-bis(hydroxymethyl)-3-methyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6,10-bis(hydroxymethyl)-3-methyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
266.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3S,3aR,6E,10Z,11aR)-6,10-bis(hydroxymethyl)-3-methyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R,3aS,6E,10Z,11aS)-6,10-bis(hydroxymethyl)-3-methyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3S,3aS,6Z,10Z,11aS)-6,10-bis(hydroxymethyl)-3-methyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₄
0 references
canonical SMILES
O=C1OC2C=C(CO)CCC=C(CO)CCC2C1C
0 references
isomeric SMILES
C[C@H]1C(=O)O[C@H]2/C=C(\CO)CC/C=C(/CO)CC[C@H]21
0 references
found in taxon
Ixeris tamagawaensis
1 reference
stated in
Sesquiterpene lactones from Ixeris tamagawaensis Kitam. III.
Identifiers
InChI
InChI=1S/C15H22O4/c1-10-13-6-5-11(8-16)3-2-4-12(9-17)7-14(13)19-15(10)18/h3,7,10,13-14,16-17H,2,4-6,8-9H2,1H3/b11-3+,12-7-/t10-,13+,14+/m1/s1
0 references
InChIKey
FZXDIRFGXUFCPH-FBOXDNNJSA-N
0 references
PubChem CID
163011047
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FZXDIRFGXUFCPH-FBOXDNNJSA-N
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