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(Q105127310)
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English
[(2E,6E,8S,10E)-8-acetyloxy-12-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(8-Acetyloxy-12-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl) acetate
1 reference
based on heuristic
inferred from SMILES
mass
338.20932406
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₃₀O₅
0 references
canonical SMILES
O=C(OCC=C(C)CCC=C(C)C(OC(=O)C)CC=C(C)CO)C
0 references
isomeric SMILES
CC(=O)OC/C=C(\C)CC/C=C(\C)[C@H](C/C=C(\C)CO)OC(C)=O
0 references
found in taxon
Ursinia anthemoides
1 reference
stated in
Sesquiterpene lactones and other constituents from Ursinia species
Identifiers
InChI
InChI=1S/C19H30O5/c1-14(11-12-23-17(4)21)7-6-8-16(3)19(24-18(5)22)10-9-15(2)13-20/h8-9,11,19-20H,6-7,10,12-13H2,1-5H3/b14-11+,15-9+,16-8+/t19-/m0/s1
0 references
InChIKey
JGEWUIBXRZWCKD-NLGPPDNISA-N
0 references
PubChem CID
163001038
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JGEWUIBXRZWCKD-NLGPPDNISA-N
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