1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione; methylphosphonic acid

Systemtic Name: 1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione; methylphosphonic acid Openeye Name: 1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione; methylphosphonic acid CAS Name: 1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-methylpyrimidine-2,4-dione; methylphosphonic acid IUPAC Name: 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione; methylphosphonic acid Traditional Name: 1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-5-methyl-pyrimidine-2,4-quinone; methylphosphonic acid Formula: C81H117N16O43P MolecularWeight: 2033.850841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CP(=O)(O)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O.CP(=O)(O)O

InChI

InChI=1S/8C10H14N2O5.CH5O3P/c8*1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8;1-5(2,3)4/h8*3,6-8,13-14H,2,4H2,1H3,(H,11,15,16);1H3,(H2,2,3,4)