[(1S,2S,3aR,5S,5aR,6S,9R,9aR,10R,10aR)-1,5,9-triacetyloxy-9a-(acetyloxymethyl)-3a-hydroxy-2,5-dimethyl-4-oxo-6-prop-1-en-2-yl-1,2,3,5a,6,9,10,10a-octahydrobenzo[f]azulen-10-yl] benzoate
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[(1S,2S,3aR,5S,5aR,6S,9R,9aR,10R,10aR)-1,5,9-triacetyloxy-9a-(acetyloxymethyl)-3a-hydroxy-2,5-dimethyl-4-oxo-6-prop-1-en-2-yl-1,2,3,5a,6,9,10,10a-octahydrobenzo[f]azulen-10-yl] benzoate
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CAS No:
204199-83-7
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Formula:
C35H42O12
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Chemical Name:
[(1S,2S,3aR,5S,5aR,6S,9R,9aR,10R,10aR)-1,5,9-triacetyloxy-9a-(acetyloxymethyl)-3a-hydroxy-2,5-dimethyl-4-oxo-6-prop-1-en-2-yl-1,2,3,5a,6,9,10,10a-octahydrobenzo[f]azulen-10-yl] benzoate
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Synonyms:
decipinone;NSC709310;NSC-709310;204199-83-7
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CAS No:
[(1S,2S,3aR,5S,5aR,6S,9R,9aR,10R,10aR)-1,5,9-triacetyloxy-9a-(acetyloxymethyl)-3a-hydroxy-2,5-dimethyl-4-oxo-6-prop-1-en-2-yl-1,2,3,5a,6,9,10,10a-octahydrobenzo[f]azulen-10-yl] benzoate Basic Attributes
654.7 g/mol
654.26762677 g/mol
709310
Computed Properties
Molecular Weight:654.7
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:13
Exact Mass:654.26762677
Monoisotopic Mass:654.26762677
Topological Polar Surface Area:169
Heavy Atom Count:47
Complexity:1350
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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