Aeroplysinin
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Aeroplysinin
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CAS No:
28656-91-9
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Formula:
C9H9Br2NO3
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Chemical Name:
Aeroplysinin
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Synonyms:
2,4-Cyclohexadiene-1-acetonitrile,3,5-dibromo-1,6-dihydroxy-4-methoxy-,(1S,6R)-;2,4-Cyclohexadiene-1-acetonitrile,3,5-dibromo-1,6-dihydroxy-4-methoxy-,(1S-trans)-;(1S,6R)-3,5-Dibromo-1,6-dihydroxy-4-methoxy-2,4-cyclohexadiene-1-acetonitrile;Aeroplysinin I,(+)-;(+)-Aeroplysinin I;Aeroplysinin I;Aeroplysinin 1;Aeroplysinin;NSC 170364;(+)Shy-Aeroplysinin-1;34140-52-8
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CAS No:
Computed Properties
Molecular Weight:338.98
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:338.89287
Monoisotopic Mass:336.89492
Topological Polar Surface Area:73.5
Heavy Atom Count:15
Complexity:382
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes