(2S,3S,4R,5R,6R)-6-[[(2S,5R)-3-azanyl-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]-oxidanyl-methyl]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4R,5R,6R)-6-[[(2S,5R)-3-azanyl-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]-oxidanyl-methyl]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: (2S,3S,4R,5R,6R)-6-[[(2S,5R)-3-amino-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]-hydroxy-methyl]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4R,5R,6R)-6-[[(2S,5R)-3-amino-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]-hydroxymethyl]-3,4,5-trihydroxy-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4R,5R,6R)-6-[[(2S,5R)-3-amino-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]-hydroxymethyl]-3,4,5-trihydroxyoxane-2-carboxylic acid Traditional Name: (2S,3S,4R,5R,6R)-6-[[(2S,5R)-3-amino-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]-hydroxy-methyl]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid Formula: C16H23N3O10 MolecularWeight: 417.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)C(C3C(C(C(C(O3)C(=O)O)O)O)O)O)N

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2CC([C@H](O2)C([C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)O)N

InChI

InChI=1S/C16H23N3O10/c1-4-3-19(16(27)18-14(4)24)6-2-5(17)11(28-6)10(23)12-8(21)7(20)9(22)13(29-12)15(25)26/h3,5-13,20-23H,2,17H2,1H3,(H,25,26)(H,18,24,27)/t5?,6-,7-,8-,9+,10?,11+,12-,13+/m1/s1