[(2R,3R,4S,5R,6R)-6-[[(3aS,4R,7aS)-1,3,6-tris(oxidanylidene)-4,5,7,7a-tetrahydro-3aH-2-benzofuran-4-yl]oxy]-3,4,5-triacetyloxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-6-[[(3aS,4R,7aS)-1,3,6-tris(oxidanylidene)-4,5,7,7a-tetrahydro-3aH-2-benzofuran-4-yl]oxy]-3,4,5-triacetyloxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-6-[[(3aS,4R,7aS)-1,3,6-trioxo-4,5,7,7a-tetrahydro-3aH-isobenzofuran-4-yl]oxy]-3,4,5-triacetoxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-6-[[(3aS,4R,7aS)-1,3,6-trioxo-4,5,7,7a-tetrahydro-3aH-isobenzofuran-4-yl]oxy]-3,4,5-triacetyloxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-6-[[(3aS,4R,7aS)-1,3,6-trioxo-4,5,7,7a-tetrahydro-3aH-2-benzofuran-4-yl]oxy]-3,4,5-triacetyloxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-6-[[(3aS,4R,7aS)-1,3,6-triketo-4,5,7,7a-tetrahydro-3aH-isobenzofuran-4-yl]oxy]-3,4,5-triacetoxy-tetrahydropyran-2-yl]methyl ester Formula: C22H26O14 MolecularWeight: 514.43344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2CC(=O)CC3C2C(=O)OC3=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@@H](O1)O[C@@H]2CC(=O)C[C@H]3[C@@H]2C(=O)OC3=O)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H26O14/c1-8(23)30-7-15-17(31-9(2)24)18(32-10(3)25)19(33-11(4)26)22(35-15)34-14-6-12(27)5-13-16(14)21(29)36-20(13)28/h13-19,22H,5-7H2,1-4H3/t13-,14+,15+,16-,17+,18-,19+,22+/m0/s1