(2R,3S,4R,5R)-2-[3-(hydroxymethyl)-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxy-3,4,5-tris(oxidanyl)-6-[(2S,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-hexanal

Systemtic Name: (2R,3S,4R,5R)-2-[3-(hydroxymethyl)-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxy-3,4,5-tris(oxidanyl)-6-[(2S,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-hexanal Openeye Name: (2R,3S,4R,5R)-3,4,5-trihydroxy-2-[[4-hydroxy-3-(hydroxymethyl)-9,10-dioxo-2-anthryl]oxy]-6-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-hexanal CAS Name: (2R,3S,4R,5R)-3,4,5-trihydroxy-2-[[4-hydroxy-3-(hydroxymethyl)-9,10-dioxo-2-anthracenyl]oxy]-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxy-2-oxanyl]oxy]hexanal IUPAC Name: (2R,3S,4R,5R)-3,4,5-trihydroxy-2-[4-hydroxy-3-(hydroxymethyl)-9,10-dioxoanthracen-2-yl]oxy-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyhexanal Traditional Name: (2R,3S,4R,5R)-3,4,5-trihydroxy-2-[(4-hydroxy-9,10-diketo-3-methylol-2-anthryl)oxy]-6-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-hexanal Formula: C26H28O14 MolecularWeight: 564.49212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)OCC(C(C(C(C=O)OC2=C(C(=C3C(=C2)C(=O)C4=CC=CC=C4C3=O)O)CO)O)O)O)O)O)O

Isomeric SMILES

C1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@H]([C@H]([C@@H]([C@H](C=O)OC2=C(C(=C3C(=C2)C(=O)C4=CC=CC=C4C3=O)O)CO)O)O)O)O)O)O

InChI

InChI=1S/C26H28O14/c27-6-13-16(5-12-18(21(13)33)20(32)11-4-2-1-3-10(11)19(12)31)40-17(7-28)24(36)22(34)14(29)8-38-26-25(37)23(35)15(30)9-39-26/h1-5,7,14-15,17,22-27,29-30,33-37H,6,8-9H2/t14-,15-,17+,22-,23+,24-,25-,26-/m1/s1