Glycoside
GD091223
Name:
NoneFormula:
C21H30O5N6Smiles:
O=C1CCCCN1CC1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CC1Aglycone:
O=C1CCCCN1CC1CCN(c2ncnc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 446.51 | Num_heavy_atoms: | 32 |
| TPSA: | 137.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD39772
Formula: C16H21ON6
Smiles:
O=C1CCCCN1CC1CCN(c2ncnc3c2N=C[N]3)CC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.62 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.39 | Num_heavy_atoms: | 23 |
| TPSA: | 75.79 | NumAromaticRings: | 1 |
