(2S,3S,4S,5R,6R)-6-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R,6R)-6-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]oxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-nitrooxy-2,2-bis(nitrooxymethyl)propoxy]tetrahydropyran-2-carboxylic acid Formula: C11H17N3O16 MolecularWeight: 447.26318

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])OC1C(C(C(C(O1)C(=O)O)O)O)O

Isomeric SMILES

C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O

InChI

InChI=1S/C11H17N3O16/c15-5-6(16)8(9(18)19)30-10(7(5)17)26-1-11(2-27-12(20)21,3-28-13(22)23)4-29-14(24)25/h5-8,10,15-17H,1-4H2,(H,18,19)/t5-,6-,7+,8-,10+/m0/s1