1-Hydroxysulfurmycin B
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1-Hydroxysulfurmycin B
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CAS No:
79217-18-8
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Formula:
C43H51NO17
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Chemical Name:
1-Hydroxysulfurmycin B
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Synonyms:
1-hydroxysulfurmycin B;1-Hydroxysulfurmycin B;1-Naphthacenecarboxylic acid, 4-((O-2''',3''-anhydro-3,6-dideoxy-alpha-L-erythro-hexopyranos-4-ulosyl-(1->4)-O-2,6-dideoxy-alpha-L-lyxo-hexopyranosyl-(1->4)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-1,2,3,4,6,11-hexahydro-2,5,7,10-tetrahydroxy-6,11-dioxo-2-(2-oxopropyl)-, methyl ester, (1R-(1alpha,2beta,4beta))-;methyl 4-[4-(dimethylamino)-5-[(2,9-dimethyl-3-oxo-4,4a,5a,6,7,9,9a,10a-octahydrodipyrano[4,2-a:4',3'-e][1,4]dioxin-7-yl)oxy]-6-methyloxan-2-yl]oxy-2,5,7,10-tetrahydroxy-6,11-dioxo-2-(2-oxopropyl)-3,4-dihydro-1H-tetracene-1-carboxylate
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CAS No:
Computed Properties
Molecular Weight:853.9
XLogP3:2.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:9
Exact Mass:853.31569916
Monoisotopic Mass:853.31569916
Topological Polar Surface Area:243
Heavy Atom Count:61
Complexity:1710
Undefined Atom Stereocenter Count:14
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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