6'''-O-Mannopyranosyl mannosidostreptomycin
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6'''-O-Mannopyranosyl mannosidostreptomycin
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CAS No:
100759-54-4
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Formula:
C33H59N7O22
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Chemical Name:
6'''-O-Mannopyranosyl mannosidostreptomycin
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Synonyms:
2,2'-(4-{[hexopyranosyl-(1->6)hexopyranosyl-(1->4)-2-deoxy-2-(methylamino)hexopyranosyl-(1->2)-5-deoxy-3-C-formylpentofuranosyl]oxy}-2,5,6-trihydroxycyclohexane-1,3-diyl)diguanidine; 6'''-O-Mannopyranosyl mannosidostreptomycin; 6'''-Mpms; 2-[3-(diaminomethylideneamino)-4-[4-formyl-4-hydroxy-3-[4-hydroxy-6-(hydroxymethyl)-3-(methylamino)-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-5-methyloxolan-2-yl]oxy-2;
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CAS No:
Computed Properties
Molecular Weight:905.9
XLogP3:-12.3
Hydrogen Bond Donor Count:18
Hydrogen Bond Acceptor Count:25
Rotatable Bond Count:15
Exact Mass:905.37131654
Monoisotopic Mass:905.37131654
Topological Polar Surface Area:495
Heavy Atom Count:62
Complexity:1540
Undefined Atom Stereocenter Count:25
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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