Glycoside
GD001586
Name:
NoneFormula:
C21H30O6N6Smiles:
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H]2Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(C)(C)OC(=O)N1C2CCC1C(Nc1ncnc3c1N=C[N]3)C2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 462.51 | Num_heavy_atoms: | 33 |
| TPSA: | 155.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD01577
Formula: C16H21O2N6
Smiles:
CC(C)(C)OC(=O)N1C2CCC1C(Nc1ncnc3c1N=C[N]3)C2| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 329.38 | Num_heavy_atoms: | 24 |
| TPSA: | 93.81 | NumAromaticRings: | 1 |
