12a-Deoxytetracycline
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12a-Deoxytetracycline
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CAS No:
4199-36-4
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Formula:
C22H24N2O7
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Chemical Name:
12a-Deoxytetracycline
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Synonyms:
2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12-tetrahydroxy-6-methyl-1,11-dioxo-,(4S,4aR,5aS,6S,12aR)-;2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12-tetrahydroxy-6-methyl-1,11-dioxo-;2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12-tetrahydroxy-6-methyl-1,11-dioxo-,[4S-(4α,4aα,5aα,6β,12aα)]-;(4S,4aR,5aS,6S,12aR)-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12-tetrahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide;12a-Deoxytetracycline;1178536-88-3
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CAS No:
Computed Properties
Molecular Weight:428.4
XLogP3:1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:428.15835111
Monoisotopic Mass:428.15835111
Topological Polar Surface Area:161
Heavy Atom Count:31
Complexity:923
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes