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(Q105123597)
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English
[(E,2Z,7R)-7-hydroxy-2-[(E)-6-hydroxy-4-(hydroxymethyl)hex-4-enylidene]-6,10-dimethyl-9-methylideneundec-5-enyl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[7-Hydroxy-2-[6-hydroxy-4-(hydroxymethyl)hex-4-enylidene]-6,10-dimethyl-9-methylideneundec-5-enyl] acetate
1 reference
based on heuristic
inferred from SMILES
mass
394.271924316
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₃₈O₅
0 references
canonical SMILES
O=C(OCC(=CCCC(=CCO)CO)CCC=C(C)C(O)CC(=C)C(C)C)C
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isomeric SMILES
C=C(C[C@@H](O)/C(C)=C/CC/C(=C/CC/C(=C\CO)CO)COC(C)=O)C(C)C
0 references
found in taxon
Lasiolaena morii
1 reference
stated in
Guaianolides and homoditerpenes from Lasiolaena morii
Identifiers
InChI
InChI=1S/C23H38O5/c1-17(2)19(4)14-23(27)18(3)8-6-10-22(16-28-20(5)26)11-7-9-21(15-25)12-13-24/h8,11-12,17,23-25,27H,4,6-7,9-10,13-16H2,1-3,5H3/b18-8+,21-12+,22-11-/t23-/m1/s1
0 references
InChIKey
IZYHHCDDTQGBQG-XNMSNBQNSA-N
0 references
PubChem CID
163029940
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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