11,17-Dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl 8-{[2-(diethylamino)ethyl](ethyl)amino}-8-oxooctanoate
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amino}-8-oxooctanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/29b127b864e74bdca97ca0fb0c2e08e2.png "11,17-Dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl 8-{[2-(diethylamino)ethyl](ethyl)amino}-8-oxooctanoate")
11,17-Dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl 8-{[2-(diethylamino)ethyl](ethyl)amino}-8-oxooctanoate
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CAS No:
96608-40-1
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Formula:
C38H60N2O7
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Chemical Name:
11,17-Dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl 8-{[2-(diethylamino)ethyl](ethyl)amino}-8-oxooctanoate
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Synonyms:
6-methylprednisolone-21-hemisuberate N,N,N'-triethylenediamine amide;6-methylprednisolone-21-hemisuberate N,N,N'-triethylenediamine amide monohydrochloride, (6alpha,11beta)-isomer;TMPS;96608-40-1;6-Methylprednisolone-21-hemisuberate N,N,N'-triethylenediamine amide;DTXSID30914429;[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 8-[2-(diethylamino)ethyl-ethylamino]-8-oxooctanoate;11,17-Dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl 8-{[2-(diethylamino)ethyl](ethyl)amino}-8-oxooctanoate;Pregna-1,4-diene-3,20-dione, 21-((8-((2-(diethylamino)ethyl)ethylamino)-1,8-dioxooctyl)oxy)-11,17-dihydroxy-6-methyl-, (6alpha,11beta)-
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CAS No:
11,17-Dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl 8-{[2-(diethylamino)ethyl](ethyl)amino}-8-oxooctanoate Basic Attributes
656.9 g/mol
656.44005226 g/mol
Computed Properties
Molecular Weight:656.9
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:17
Exact Mass:656.44005226
Monoisotopic Mass:656.44005226
Topological Polar Surface Area:124
Heavy Atom Count:47
Complexity:1230
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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