(2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromanyl-6-oxidanyl-oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromanyl-6-oxidanyl-oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-bromo-6-hydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromo-6-hydroxy-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromo-6-hydroxyoxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-bromo-6-hydroxy-tetrahydropyran-2-carboxylic acid Formula: C12H15BrO10 MolecularWeight: 399.1455

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(OC1C(=O)O)(O)Br)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H]1[C@@H]([C@H]([C@](O[C@@H]1C(=O)O)(O)Br)OC(=O)C)OC(=O)C

InChI

InChI=1S/C12H15BrO10/c1-4(14)20-7-8(21-5(2)15)10(22-6(3)16)12(13,19)23-9(7)11(17)18/h7-10,19H,1-3H3,(H,17,18)/t7-,8-,9-,10+,12+/m0/s1