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(Q105182159)
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English
[(4R,6S,9E,11R)-9,14-dimethyl-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradeca-1(14),9-dien-4-yl]methyl (Z)-2-methylbut-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(9,14-Dimethyl-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradeca-1(14),9-dien-4-yl)methyl 2-methylbut-2-enoate
1 reference
based on heuristic
inferred from SMILES
mass
346.178023932
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₆O₅
0 references
canonical SMILES
O=C(OCC12OC2CCC(=CC3OC(=O)C(=C3CC1)C)C)C(=CC)C
0 references
isomeric SMILES
C/C=C(/C)C(=O)OC[C@]12CCC3=C(C)C(=O)O[C@@H]3/C=C(\C)CC[C@@H]1O2
0 references
found in taxon
Torilis japonica
1 reference
stated in
Structures of torilolide and oxytorilolide ; Two novel germacranolides from Torilis japonica (Houtt.) DC.
Identifiers
InChI
InChI=1S/C20H26O5/c1-5-13(3)18(21)23-11-20-9-8-15-14(4)19(22)24-16(15)10-12(2)6-7-17(20)25-20/h5,10,16-17H,6-9,11H2,1-4H3/b12-10+,13-5-/t16-,17+,20-/m1/s1
0 references
InChIKey
NNJJZBWGTBSKOJ-OPNRGDNUSA-N
0 references
PubChem CID
163049603
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NNJJZBWGTBSKOJ-OPNRGDNUSA-N
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