10,13-dimethyl-17-[2-(6-methylsulfanylpurin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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![10,13-dimethyl-17-[2-(6-methylsulfanylpurin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/87beff684f9d41dfb7547a2b1819b77e.png "10,13-dimethyl-17-[2-(6-methylsulfanylpurin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one")
10,13-dimethyl-17-[2-(6-methylsulfanylpurin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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CAS No:
21170-27-4
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Formula:
C27H34N4O2S
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Chemical Name:
10,13-dimethyl-17-[2-(6-methylsulfanylpurin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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Synonyms:
NSC109131;MLS002701958;21170-27-4;21-[6-(methylsulfanyl)-9h-purin-9-yl]pregn-4-ene-3,20-dione;CHEMBL1714096;DTXSID10943499;NCI60_000214;SMR001565539;21-(6-(methylthio)-9H-purin-9-yl)pregn-4-ene-3,20-dione;10,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one
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CAS No:
10,13-dimethyl-17-[2-(6-methylsulfanylpurin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Basic Attributes
478.7 g/mol
478.24024751 g/mol
109131
Computed Properties
Molecular Weight:478.7
XLogP3:4.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:478.24024751
Monoisotopic Mass:478.24024751
Topological Polar Surface Area:103
Heavy Atom Count:34
Complexity:894
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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