(2S,3S,4S,5R,6S)-5-acetyloxy-4-azido-3-oxidanyl-6-phenylsulfanyl-oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R,6S)-5-acetyloxy-4-azido-3-oxidanyl-6-phenylsulfanyl-oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R,6S)-5-acetoxy-4-azido-3-hydroxy-6-phenylsulfanyl-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R,6S)-5-acetyloxy-4-azido-3-hydroxy-6-(phenylthio)-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R,6S)-5-acetyloxy-4-azido-3-hydroxy-6-phenylsulfanyloxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R,6S)-5-acetoxy-4-azido-3-hydroxy-6-(phenylthio)tetrahydropyran-2-carboxylic acid Formula: C14H15N3O6S MolecularWeight: 353.3504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(OC1SC2=CC=CC=C2)C(=O)O)O)N=[N+]=[N-]

Isomeric SMILES

CC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1SC2=CC=CC=C2)C(=O)O)O)N=[N+]=[N-]

InChI

InChI=1S/C14H15N3O6S/c1-7(18)22-11-9(16-17-15)10(19)12(13(20)21)23-14(11)24-8-5-3-2-4-6-8/h2-6,9-12,14,19H,1H3,(H,20,21)/t9-,10-,11+,12-,14-/m0/s1