(2R,3S,4R,6S,7S)-2-(hydroxymethyl)-7-(2-methylphenoxy)oxepane-3,4,5,6-tetrol

Systemtic Name: (2R,3S,4R,6S,7S)-2-(hydroxymethyl)-7-(2-methylphenoxy)oxepane-3,4,5,6-tetrol Openeye Name: (2R,3S,4R,6S,7S)-2-(hydroxymethyl)-7-(2-methylphenoxy)oxepane-3,4,5,6-tetrol CAS Name: (2R,3S,4R,6S,7S)-2-(hydroxymethyl)-7-(2-methylphenoxy)oxepane-3,4,5,6-tetrol IUPAC Name: (2R,3S,4R,6S,7S)-2-(hydroxymethyl)-7-(2-methylphenoxy)oxepane-3,4,5,6-tetrol Traditional Name: (2R,3S,4R,6S,7S)-2-methylol-7-(2-methylphenoxy)oxepane-3,4,5,6-tetrol Formula: C14H20O7 MolecularWeight: 300.3044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2C(C(C(C(C(O2)CO)O)O)O)O

Isomeric SMILES

CC1=CC=CC=C1O[C@H]2[C@H](C([C@H]([C@@H]([C@H](O2)CO)O)O)O)O

InChI

InChI=1S/C14H20O7/c1-7-4-2-3-5-8(7)20-14-13(19)12(18)11(17)10(16)9(6-15)21-14/h2-5,9-19H,6H2,1H3/t9-,10-,11+,12?,13+,14-/m1/s1