(3R,4S,5R,6R)-6-(hydroxymethyl)-3-[3-(3-methoxyspiro[1,2-dioxetane-4,2'-adamantane]-3-yl)phenyl]oxane-2,3,4,5-tetrol

Systemtic Name: (3R,4S,5R,6R)-6-(hydroxymethyl)-3-[3-(3-methoxyspiro[1,2-dioxetane-4,2'-adamantane]-3-yl)phenyl]oxane-2,3,4,5-tetrol Openeye Name: (3R,4S,5R,6R)-6-(hydroxymethyl)-3-[3-(3'-methoxyspiro[adamantane-2,4'-dioxetane]-3'-yl)phenyl]tetrahydropyran-2,3,4,5-tetrol CAS Name: (3R,4S,5R,6R)-6-(hydroxymethyl)-3-[3-(3'-methoxy-3'-spiro[adamantane-2,4'-dioxetane]yl)phenyl]oxane-2,3,4,5-tetrol IUPAC Name: (3R,4S,5R,6R)-6-(hydroxymethyl)-3-[3-(3'-methoxyspiro[adamantane-2,4'-dioxetane]-3'-yl)phenyl]oxane-2,3,4,5-tetrol Traditional Name: (3R,4S,5R,6R)-3-[3-(3'-methoxyspiro[adamantane-2,4'-dioxetane]-3'-yl)phenyl]-6-methylol-tetrahydropyran-2,3,4,5-tetrol Formula: C24H32O9 MolecularWeight: 464.50548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1(C2(C3CC4CC(C3)CC2C4)OO1)C5=CC=CC(=C5)C6(C(C(C(OC6O)CO)O)O)O

Isomeric SMILES

COC1(C2(C3CC4CC(C3)CC2C4)OO1)C5=CC=CC(=C5)[C@]6([C@H]([C@H]([C@H](OC6O)CO)O)O)O

InChI

InChI=1S/C24H32O9/c1-30-24(23(32-33-24)16-6-12-5-13(8-16)9-17(23)7-12)15-4-2-3-14(10-15)22(29)20(27)19(26)18(11-25)31-21(22)28/h2-4,10,12-13,16-21,25-29H,5-9,11H2,1H3/t12?,13?,16?,17?,18-,19+,20+,21?,22-,23?,24?/m1/s1