Glycoside
GD039854
Name:
1-(beta-d-ribofuranosyl)-pyridin-4-one-5'-phosphateFormula:
C10H14O8NPSmiles:
O=c1ccn([C@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]2O)cc1Aglycone:
COP(=O)(O)O.O=c1cc[nH]cc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 4 |
| MolWt: | 307.19 | Num_heavy_atoms: | 20 |
| TPSA: | 138.45 | 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 |
AD15022
Formula: C5H5ON
Smiles:
O=c1cc[nH]cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 0 |
| MolWt: | 95.1 | Num_heavy_atoms: | 7 |
| TPSA: | 32.86 | NumAromaticRings: | 1 |
