 Home > Encyclopedia > methyl 4-[5-[5-(5-acetamido-6-methyloxan-2-yl)oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate

methyl 4-[5-[5-(5-acetamido-6-methyloxan-2-yl)oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate

methyl 4-[5-[5-(5-acetamido-6-methyloxan-2-yl)oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate structure

CAS No:
79366-08-8
Formula:
C44H58N2O15
Chemical Name:
methyl 4-[5-[5-(5-acetamido-6-methyloxan-2-yl)oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
Synonyms:
4'''-aclacinomycinamide;79366-08-8;4'''-Aclacinomycinamide;4'''(R)-N-Acetamideaclacinomycin A;79391-09-6;DTXSID501000426;1-Naphthacenecarboxylic acid, 4-((4-O-(4-O-((2S-(2alpha,5alpha,6beta))-5-(acetylamino)tetrahydro-6-methyl-2H-pyran-2-yl)-2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-, methyl ester, (1R-(1alpha,2beta,4beta))-;Methyl (1R-(1alpha,2beta,4beta))-4-((4-O-(4-O-((2S-(2alpha,5alpha,6beta))-5-(acetylamino)tetrahydro-6-methyl-2H-pyran-2-yl)-2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-1-naphthacenecarboxylate;Methyl 4-((4-O-(4-O-((2S-(2alpha,5alpha,6beta))-5-(acetylamino)tetrahydro-6-methyl-2H-pyran-2-yl)-2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-1-naphthacenecarboxylate (1R-(1alpha,2beta,4beta))-;1-Naphthacenecarboxylic acid, 4-((4-O-(4-O-((2S-(2alpha,5beta,6beta))-5-(acetylamino)tetrahydro-6-methyl-2H-pyran-2-yl)-2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-d ioxo-, methyl ester, (1R-(1alpha,2beta,4beta))-;3-Ethyl-3,10,12-trihydroxy-4-(methoxycarbonyl)-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-4-O-(2,6-dideoxy-4-O-{5-[(1-hydroxyethylidene)amino]-6-methyloxan-2-yl}hexopyranosyl)-3-(di

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methyl 4-[5-[5-(5-acetamido-6-methyloxan-2-yl)oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate Basic Attributes

Molecular Weight：

854.9 g/mol

Exact Mass：

854.38371915 g/mol

Characteristics

PSA：

229 Å²

Drug Information

MeSH Entry Terms：

4'''-aclacinomycinamide

Computed Properties

Molecular Weight:854.9
XLogP3:3.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:11
Exact Mass:854.38371915
Monoisotopic Mass:854.38371915
Topological Polar Surface Area:229
Heavy Atom Count:61
Complexity:1600
Undefined Atom Stereocenter Count:14
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 4-[5-[5-(5-acetamido-6-methyloxan-2-yl)oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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