Glycoside
GD023152
Name:
NoneFormula:
C11H19O12N6P3Smiles:
Nc1ncnc2c1ncn2C1O[C@H](CCNP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H]1OAglycone:
CCNP(=O)(O)OP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.55 |
| AlogP: | -1.67 | Num_rotatable_bonds: | 9 |
| MolWt: | 520.23 | Num_heavy_atoms: | 32 |
| TPSA: | 281.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD15603
Formula: C2H10O9NP3
Smiles:
CCNP(=O)(O)OP(=O)(O)OP(=O)(O)O| HBA: | 10 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 285.02 | Num_heavy_atoms: | 15 |
| TPSA: | 162.62 | NumAromaticRings: | 0 |
