Glycoside
GD008465
Name:
NoneFormula:
C10H14O9N3PSmiles:
NC(=O)c1nccn([C@@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@H]2O)c1=OAglycone:
COP(=O)(O)O.NC(=O)c1ncc[nH]c1=OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 351.21 | Num_heavy_atoms: | 23 |
| TPSA: | 194.43 | 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 |
AD00903
Formula: C5H5O2N3
Smiles:
NC(=O)c1ncc[nH]c1=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.11 | Num_heavy_atoms: | 10 |
| TPSA: | 88.84 | NumAromaticRings: | 1 |
