Glycoside
GD037748
Name:
1-deoxy-1-[6-(hydroxymethyl)-2,4-dioxo-3,4-dihydropteridin-8(2h)-yl]-d-arabinitolFormula:
C12H16O7N4Smiles:
O=c1nc2n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)cc(CO)nc-2c(=O)[nH]1Aglycone:
Cn1cc(CO)nc2c(=O)[nH]c(=O)nc1-2Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -4.0 | Num_rotatable_bonds: | 6 |
| MolWt: | 328.28 | Num_heavy_atoms: | 23 |
| TPSA: | 181.79 | NumAromaticRings: | 0 |
Unique Aglycone
AD23722
Formula: C8H8O3N4
Smiles:
Cn1cc(CO)nc2c(=O)[nH]c(=O)nc1-2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 1 |
| MolWt: | 208.18 | Num_heavy_atoms: | 15 |
| TPSA: | 100.87 | NumAromaticRings: | 0 |
