Products 31077-70-0

CAS 31077-70-0 is the registry number for 3''-Deamino-3''-hydroxykanamycin B. Offered by: MedChemExpress. Available pack sizes: Get quote.

3''-Deamino-3''-hydroxykanamycin B
MedChemExpress
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Structural formula: {0} (CAS {1})

3''-deamino-3''-hydroxykanamycin B is a kanamycin that is kanamycin B in which the 3''-amino group has been replaced by a hydroxy group. It is functionally related to a kanamycin B. It is a conjugate base of a 3''-deamino-3''-hydroxykanamycin B(4+).

Source: ChEBI

Identity
Molecular formulaC18H36N4O11
Molecular weight484.5 g/mol
IUPAC name(2S,3R,4S,5S,6R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChIKeyMOWMHIINUAQFMU-DNBVWFFRSA-N
SMILESC1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)N)N

Computed by PubChem (NCBI)

Synonyms: Nebramycin III, 3''-deamino-3''-hydroxykanamycin B, NEBRAMYCIN III, (+)-, Nebramycin factor 3, 3"-Deamino-3"-hydroxykanamycin B, orb3174955, '3"-deamino-3"-hydroxykanamycin B'
Isomers (same molecular formula)
(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxyoxane-3,4,5-triol C18H36N4O11
(2S,3R,4S,5S,6R)-4-amino-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-(hydroxymethyl)oxane-3,5-diol C18H36N4O11
(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxyoxane-3,4,5-triol C18H36N4O11
(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxyoxane-3,4,5-triol C18H36N4O11
2-(aminomethyl)-6-[2,4-diamino-5-[3,5-dihydroxy-4-(methylamino)oxan-2-yl]oxy-3,6-dihydroxycyclohexyl]oxyoxane-3,4,5-triol C18H36N4O11

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