Glycoside
GD039951
Name:
1-deoxy-1-({2,6-dioxo-5-[(e)-(2-oxopropylidene)amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-d-ribitolFormula:
C12H18O7N4Smiles:
CC(=O)C=Nc1c(NC[C@@H](O)[C@@H](O)[C@@H](O)CO)[nH]c(=O)[nH]c1=OAglycone:
CNc1[nH]c(=O)[nH]c(=O)c1N=CC(C)=OSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -3.16 | Num_rotatable_bonds: | 8 |
| MolWt: | 330.3 | Num_heavy_atoms: | 23 |
| TPSA: | 188.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD24605
Formula: C8H10O3N4
Smiles:
CNc1[nH]c(=O)[nH]c(=O)c1N=CC(C)=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 210.19 | Num_heavy_atoms: | 15 |
| TPSA: | 107.18 | NumAromaticRings: | 1 |
