Glycoside
GD039940
Name:
1-(beta-d-ribofuranosyl)-pyrimidin-2-one-5'-phosphateFormula:
C9H13O8N2PSmiles:
O=c1ncccn1[C@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]1OAglycone:
COP(=O)(O)O.O=c1nccc[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 308.18 | Num_heavy_atoms: | 20 |
| TPSA: | 151.34 | NumAromaticRings: | 1 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD05444
Formula: C4H4ON2
Smiles:
O=c1nccc[nH]1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 0 |
| MolWt: | 96.09 | Num_heavy_atoms: | 7 |
| TPSA: | 45.75 | NumAromaticRings: | 1 |
