Products 30461-82-6

CAS 30461-82-6 is the registry number for Blood group A hexasaccharide type II. Offered by: Biosynth. Available pack sizes: 2mg, 1mg, 5mg.

Structural formula: {0} (CAS {1})

N-[(2R,4R,5R)-2-[(2S,4S,5S)-2-[(3S,4R,6S)-5-acetamido-6-[(3S,4S,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3S,4R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CAS 30461-82-6) is a chemical compound with the molecular formula C40H68N2O30 and a molecular weight of 1057.0 g/mol. IUPAC name: N-[(2R,4R,5R)-2-[(2S,4S,5S)-2-[(3S,4R,6S)-5-acetamido-6-[(3S,4S,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3S,4R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide. InChIKey: NGRVABFTTBQXSB-ZGXHURQDSA-N.

Identity
Molecular formulaC40H68N2O30
Molecular weight1057.0 g/mol
IUPAC nameN-[(2R,4R,5R)-2-[(2S,4S,5S)-2-[(3S,4R,6S)-5-acetamido-6-[(3S,4S,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3S,4R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
InChIKeyNGRVABFTTBQXSB-ZGXHURQDSA-N
SMILESCC1[C@H]([C@@H](C([C@@H](O1)OC2[C@H]([C@H](C(O[C@H]2O[C@H]3[C@@H](C([C@@H](OC3CO)O[C@H]4[C@H](C(O[C@H](C4O)O[C@H]5[C@@H](C([C@@H](OC5CO)O)O)O)CO)O)NC(=O)C)O)CO)O)O[C@@H]6C([C@H]([C@H](C(O6)CO)O)O)NC(=O)C)O)O)O

Computed by PubChem (NCBI)