2,2,2-trifluoro-N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
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![2,2,2-trifluoro-N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/75465a0f8a7843f2986bdbc0e4c6f497.png "2,2,2-trifluoro-N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide")
2,2,2-trifluoro-N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
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CAS No:
134568-36-8
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Formula:
C18H14F3NO6
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Chemical Name:
2,2,2-trifluoro-N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
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Synonyms:
N-Trifluoroacetyl-N-deacetyl-1,2,3-demethylisocolchiceine;134568-36-8;Acetamide, 2,2,2-trifluoro-N-(5,6,7,10-tetrahydro-1,2,3,9-tetrahydroxy-10-oxobenzo(a)heptalen-7-yl)-, (S)-;Acetamide, 2,2,2-trifluoro-N-(5,6,7,10-tetrahydro-1,2,3,9-tetrahydroxy-10-oxobenzo[a]heptalen-7-yl)-, (S)-;CHEMBL9892;DTXSID30158806;2,2,2-trifluoro-N-[(7S)-1,2,3,9-tetrahydroxy-10-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
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CAS No:
2,2,2-trifluoro-N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Basic Attributes
397.3 g/mol
397.07732165 g/mol
DTXSID30158806
Computed Properties
Molecular Weight:397.3
XLogP3:0.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:1
Exact Mass:397.07732165
Monoisotopic Mass:397.07732165
Topological Polar Surface Area:127
Heavy Atom Count:28
Complexity:772
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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