4-Epidemeclocycline
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4-Epidemeclocycline
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CAS No:
14206-59-8
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Formula:
C21H21ClN2O8
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Chemical Name:
4-Epidemeclocycline
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Synonyms:
2-Naphthacenecarboxamide,7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-,(4R,4aS,5aS,6S,12aS)-;2-Naphthacenecarboxamide,7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-,4-epimer;2-Naphthacenecarboxamide,7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-,[4R-(4α,4aβ,5aβ,6α,12aβ)]-;(4R,4aS,5aS,6S,12aS)-7-Chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-2-naphthacenecarboxamide;4-epi-Demeclocycline;4-Epidemeclocycline;4-Epidemethylchlortetracycline
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CAS No:
4-Epidemeclocycline Use and Manufacturing
A Tetracycline analog as gelatinase inhibitorwith known efficacy, safety, and side effects; used for the treatment of diseases such as rheumatoid arthritis and multiple sclerosis.
Computed Properties
Molecular Weight:464.9
XLogP3:0.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:2
Exact Mass:464.0986433
Monoisotopic Mass:464.0986433
Topological Polar Surface Area:182
Heavy Atom Count:32
Complexity:961
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes