[(3S,4S,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate
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[(3S,4S,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate
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CAS No:
1212441-81-0
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Formula:
C17H20O5
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Chemical Name:
[(3S,4S,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate
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Synonyms:
Matricarine;NSC710842;AKOS004111039;MCULE-4633674199;NSC-710842;[(3S,4S,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate;1212441-81-0
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CAS No:
[(3S,4S,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate Basic Attributes
304.34 g/mol
304.13107373 g/mol
710842
Computed Properties
Molecular Weight:304.34
XLogP3:1.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:304.13107373
Monoisotopic Mass:304.13107373
Topological Polar Surface Area:69.7
Heavy Atom Count:22
Complexity:627
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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