Glycoside
GD015661
Name:
NoneFormula:
C16H22O10N5PSmiles:
CC(C)C(=O)Nc1nc2c(ncn2[C@@H]2O[C@H](COC(=O)CP(=O)(O)O)[C@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
CC(C)C(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2.COC(=O)CP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 7 |
| MolWt: | 475.35 | Num_heavy_atoms: | 32 |
| TPSA: | 226.19 | NumAromaticRings: | 2 |
Unique Aglycone
AD01714
Formula: C3H7O5P
Smiles:
COC(=O)CP(=O)(O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 154.06 | Num_heavy_atoms: | 9 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
AD03777
Formula: C9H10O2N5
Smiles:
CC(C)C(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 220.21 | Num_heavy_atoms: | 16 |
| TPSA: | 101.31 | NumAromaticRings: | 1 |
