Products 50642-14-3

CAS 50642-14-3 appears in our catalog under these names: Validamycin (technical), Validamycin (technical) 100 µg/mL in Acetonitrile/Water, Validamycin (technical) 100 µg/mL in Methanol. Offered by: Dr. Ehrenstorfer, Biosynth. Available pack sizes: 250mg, 1ml, 5000mg.

Validamycin (technical)
Dr. Ehrenstorfer, Biosynth
  • size: 250mg, 5000mg
  • Variants: 2
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Validamycin (technical) 100 µg/mL in Acetonitrile/Water
Dr. Ehrenstorfer
  • size: 1ml
  • Variants: 1
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Validamycin (technical) 100 µg/mL in Methanol
Dr. Ehrenstorfer
  • size: 1ml
  • Variants: 1
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Structural formula: {0} (CAS {1})

(2S,3R,4S,5S,6R)-2-[(1R,2R,3S,4S,6R)-2,3-dihydroxy-6-(hydroxymethyl)-4-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (CAS 50642-14-3) is a chemical compound with the molecular formula C20H35NO13 and a molecular weight of 497.5 g/mol. IUPAC name: (2S,3R,4S,5S,6R)-2-[(1R,2R,3S,4S,6R)-2,3-dihydroxy-6-(hydroxymethyl)-4-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol. InChIKey: JARYYMUOCXVXNK-FCFLIOTHSA-N.

Identity
Molecular formulaC20H35NO13
Molecular weight497.5 g/mol
IUPAC name(2S,3R,4S,5S,6R)-2-[(1R,2R,3S,4S,6R)-2,3-dihydroxy-6-(hydroxymethyl)-4-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChIKeyJARYYMUOCXVXNK-FCFLIOTHSA-N
SMILESC1[C@@H]([C@H]([C@@H]([C@H]([C@H]1N[C@H]2C=C([C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)CO

Computed by PubChem (NCBI)

Synonyms: Validamycins, Solacol
Related forms of this compound
(2R,3R,4S,5S,6R)-2-[(1R,2R,3S,4S,6R)-2,3-dihydroxy-6-(hydroxymethyl)-4-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C20H35NO13
Isomers (same molecular formula)
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(1S,2S,3R,4S,5R)-2,3,4-trihydroxy-5-[[(1R,4S,5R,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]methoxy]oxane-3,4,5-triol C20H35NO13