[(2R,3R,4S,5S,6R)-3-ethanoyl-6-(hydroxymethyl)-2-[(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl] hypobromite

Systemtic Name: [(2R,3R,4S,5S,6R)-3-ethanoyl-6-(hydroxymethyl)-2-[(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl] hypobromite Openeye Name: [(2R,3R,4S,5S,6R)-3-acetyl-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] hypobromite CAS Name: hypobromous acid [(2R,3R,4S,5S,6R)-3-acetyl-2-[[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-3-oxanyl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6R)-3-acetyl-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] hypobromite Traditional Name: hypobromous acid [(2R,3R,4S,5S,6R)-3-acetyl-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-methylol-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-methylol-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-6-methylol-tetrahydropyran-3-yl] ester Formula: C20H33BrO17 MolecularWeight: 625.36982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(C(C(OC1OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)CO)O)O)OBr

Isomeric SMILES

CC(=O)[C@]1([C@H]([C@@H]([C@H](O[C@@H]1O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)CO)O)O)OBr

InChI

InChI=1S/C20H33BrO17/c1-5(25)20(38-21)16(31)9(26)6(2-22)35-19(20)37-15-8(4-24)34-18(13(30)11(15)28)36-14-7(3-23)33-17(32)12(29)10(14)27/h6-19,22-24,26-32H,2-4H2,1H3/t6-,7-,8-,9-,10-,11-,12-,13-,14-,15-,16+,17?,18-,19-,20-/m1/s1