(2S,3R,4S,5R,6S)-3-[(3R,4S,5S,6S)-3-acetamido-6-carboxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-5-azanyl-4,6-bis(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (2S,3R,4S,5R,6S)-3-[(3R,4S,5S,6S)-3-acetamido-6-carboxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-5-azanyl-4,6-bis(oxidanyl)oxane-2-carboxylic acid Openeye Name: (2S,3R,4S,5R,6S)-3-[(3R,4S,5S,6S)-3-acetamido-6-carboxy-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-5-amino-4,6-dihydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3R,4S,5R,6S)-3-[[(3R,4S,5S,6S)-3-acetamido-6-carboxy-4,5-dihydroxy-2-oxanyl]oxy]-5-amino-4,6-dihydroxy-2-oxanecarboxylic acid IUPAC Name: (2S,3R,4S,5R,6S)-3-[(3R,4S,5S,6S)-3-acetamido-6-carboxy-4,5-dihydroxyoxan-2-yl]oxy-5-amino-4,6-dihydroxyoxane-2-carboxylic acid Traditional Name: (2S,3R,4S,5R,6S)-3-[(3R,4S,5S,6S)-3-acetamido-6-carboxy-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-5-amino-4,6-dihydroxy-tetrahydropyran-2-carboxylic acid Formula: C14H22N2O12 MolecularWeight: 410.33068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC2C(C(C(OC2C(=O)O)O)N)O)C(=O)O)O)O

Isomeric SMILES

CC(=O)N[C@@H]1[C@@H]([C@@H]([C@H](OC1O[C@@H]2[C@H]([C@H]([C@H](O[C@@H]2C(=O)O)O)N)O)C(=O)O)O)O

InChI

InChI=1S/C14H22N2O12/c1-2(17)16-4-6(19)7(20)9(11(21)22)28-14(4)27-8-5(18)3(15)13(25)26-10(8)12(23)24/h3-10,13-14,18-20,25H,15H2,1H3,(H,16,17)(H,21,22)(H,23,24)/t3-,4-,5+,6+,7+,8-,9+,10+,13+,14?/m1/s1