[(2R,3R,4S,5R)-3,4,5-triacetyloxy-6-[[(1R,2S,3R)-3-methyl-2,3,9,10-tetrakis(oxidanyl)-5,8-bis(oxidanylidene)-2,4-dihydro-1H-anthracen-1-yl]oxy]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R)-3,4,5-triacetyloxy-6-[[(1R,2S,3R)-3-methyl-2,3,9,10-tetrakis(oxidanyl)-5,8-bis(oxidanylidene)-2,4-dihydro-1H-anthracen-1-yl]oxy]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R)-3,4,5-triacetoxy-6-[[(1R,2S,3R)-2,3,9,10-tetrahydroxy-3-methyl-5,8-dioxo-2,4-dihydro-1H-anthracen-1-yl]oxy]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R)-3,4,5-triacetyloxy-6-[[(1R,2S,3R)-2,3,9,10-tetrahydroxy-3-methyl-5,8-dioxo-2,4-dihydro-1H-anthracen-1-yl]oxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R)-3,4,5-triacetyloxy-6-[[(1R,2S,3R)-2,3,9,10-tetrahydroxy-3-methyl-5,8-dioxo-2,4-dihydro-1H-anthracen-1-yl]oxy]oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R)-3,4,5-triacetoxy-6-[[(1R,2S,3R)-2,3,9,10-tetrahydroxy-5,8-diketo-3-methyl-2,4-dihydro-1H-anthracen-1-yl]oxy]tetrahydropyran-2-yl]methyl ester Formula: C29H32O16 MolecularWeight: 636.55478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2C(C(CC3=C(C4=C(C(=O)C=CC4=O)C(=C23)O)O)(C)O)O)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)O[C@H]2[C@@H]([C@](CC3=C(C4=C(C(=O)C=CC4=O)C(=C23)O)O)(C)O)O)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C29H32O16/c1-10(30)40-9-17-23(41-11(2)31)25(42-12(3)32)26(43-13(4)33)28(44-17)45-24-18-14(8-29(5,39)27(24)38)21(36)19-15(34)6-7-16(35)20(19)22(18)37/h6-7,17,23-28,36-39H,8-9H2,1-5H3/t17-,23-,24-,25+,26-,27+,28?,29-/m1/s1