sodium [(2R,4S,5R,6R)-5-acetamido-4-acetyloxy-2-methoxycarbonyl-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxan-2-yl] [(2R,3R,4R,5R)-3,4-diacetyloxy-5-methoxy-oxolan-2-yl]methyl phosphate

Systemtic Name: sodium [(2R,4S,5R,6R)-5-acetamido-4-acetyloxy-2-methoxycarbonyl-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxan-2-yl] [(2R,3R,4R,5R)-3,4-diacetyloxy-5-methoxy-oxolan-2-yl]methyl phosphate Openeye Name: sodium [(2R,4S,5R,6R)-5-acetamido-4-acetoxy-2-methoxycarbonyl-6-[(1S,2R)-1,2,3-triacetoxypropyl]tetrahydropyran-2-yl] [(2R,3R,4R,5R)-3,4-diacetoxy-5-methoxy-tetrahydrofuran-2-yl]methyl phosphate CAS Name: sodium [(2R,4S,5R,6R)-5-acetamido-4-acetyloxy-2-methoxycarbonyl-6-[(1S,2R)-1,2,3-triacetyloxypropyl]-2-oxanyl] [(2R,3R,4R,5R)-3,4-diacetyloxy-5-methoxy-2-oxolanyl]methyl phosphate IUPAC Name: sodium [(2R,4S,5R,6R)-5-acetamido-4-acetyloxy-2-methoxycarbonyl-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxan-2-yl] [(2R,3R,4R,5R)-3,4-diacetyloxy-5-methoxyoxolan-2-yl]methyl phosphate Traditional Name: sodium [(2R,4S,5R,6R)-5-acetamido-4-acetoxy-2-carbomethoxy-6-[(1S,2R)-1,2,3-triacetoxypropyl]tetrahydropyran-2-yl] [(2R,3R,4R,5R)-3,4-diacetoxy-5-methoxy-tetrahydrofuran-2-yl]methyl phosphate Formula: C30H43NNaO22P MolecularWeight: 823.619451

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(OC1C(C(COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OC)OP(=O)([O-])OCC2C(C(C(O2)OC)OC(=O)C)OC(=O)C)OC(=O)C.[Na+]

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1[C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OC)OP(=O)([O-])OC[C@@H]2[C@H]([C@H]([C@@H](O2)OC)OC(=O)C)OC(=O)C)OC(=O)C.[Na+]

InChI

InChI=1S/C30H44NO22P.Na/c1-13(32)31-23-20(46-15(3)34)10-30(29(39)43-9,52-26(23)24(48-17(5)36)21(47-16(4)35)11-44-14(2)33)53-54(40,41)45-12-22-25(49-18(6)37)27(50-19(7)38)28(42-8)51-22;/h20-28H,10-12H2,1-9H3,(H,31,32)(H,40,41);/q;+1/p-1/t20-,21+,22+,23+,24+,25+,26+,27+,28+,30+;/m0./s1