(3R,5S,6R)-5-acetamido-3-[(2S,3S,5R)-3-acetamido-5-azaniumyl-6-methyl-4-oxidanyl-oxan-2-yl]oxy-6-methoxy-4-oxidanyl-oxane-2-carboxylate

Systemtic Name: (3R,5S,6R)-5-acetamido-3-[(2S,3S,5R)-3-acetamido-5-azaniumyl-6-methyl-4-oxidanyl-oxan-2-yl]oxy-6-methoxy-4-oxidanyl-oxane-2-carboxylate Openeye Name: (3R,5S,6R)-5-acetamido-3-[(2S,3S,5R)-3-acetamido-5-azaniumyl-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methoxy-tetrahydropyran-2-carboxylate CAS Name: (3R,5S,6R)-5-acetamido-3-[[(2S,3S,5R)-3-acetamido-5-ammonio-4-hydroxy-6-methyl-2-oxanyl]oxy]-4-hydroxy-6-methoxy-2-oxanecarboxylate IUPAC Name: (3R,5S,6R)-5-acetamido-3-[(2S,3S,5R)-3-acetamido-5-azaniumyl-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methoxyoxane-2-carboxylate Traditional Name: (3R,5S,6R)-5-acetamido-3-[(2S,3S,5R)-3-acetamido-5-ammonio-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methoxy-tetrahydropyran-2-carboxylate Formula: C17H29N3O10 MolecularWeight: 435.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2C(C(C(OC2C(=O)[O-])OC)NC(=O)C)O)NC(=O)C)O)[NH3+]

Isomeric SMILES

CC1[C@@H](C([C@@H]([C@@H](O1)O[C@@H]2C([C@@H]([C@@H](OC2C(=O)[O-])OC)NC(=O)C)O)NC(=O)C)O)[NH3+]

InChI

InChI=1S/C17H29N3O10/c1-5-8(18)11(23)9(19-6(2)21)17(28-5)29-13-12(24)10(20-7(3)22)16(27-4)30-14(13)15(25)26/h5,8-14,16-17,23-24H,18H2,1-4H3,(H,19,21)(H,20,22)(H,25,26)/t5?,8-,9-,10-,11?,12?,13+,14?,16+,17-/m0/s1