N-(1,2,3-trihydroxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)hexadecanamide
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N-(1,2,3-trihydroxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)hexadecanamide
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CAS No:
4945-41-9
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Formula:
C33H47NO5S
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Chemical Name:
N-(1,2,3-trihydroxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)hexadecanamide
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Synonyms:
4945-41-9;NSC642311;DTXSID80964232;NSC-642311;NCI60_014324;N-[1,2,3-Trihydroxy-10-(methylsulfanyl)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]hexadecanimidic acid
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CAS No:
N-(1,2,3-trihydroxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)hexadecanamide Basic Attributes
569.8 g/mol
569.31749477 g/mol
642311
Computed Properties
Molecular Weight:569.8
XLogP3:8.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:16
Exact Mass:569.31749477
Monoisotopic Mass:569.31749477
Topological Polar Surface Area:132
Heavy Atom Count:40
Complexity:913
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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