Glycoside
GD089077
Name:
NoneFormula:
C21H26O5N6Smiles:
O=c1[nH]cnc2c1nc(N1CCN(Cc3ccccc3)CC1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1N=C(N1CCN(Cc3ccccc3)CC1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 442.48 | Num_heavy_atoms: | 32 |
| TPSA: | 139.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD38921
Formula: C16H17ON6
Smiles:
O=c1[nH]cnc2c1N=C(N1CCN(Cc3ccccc3)CC1)[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.31 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 309.35 | Num_heavy_atoms: | 23 |
| TPSA: | 78.69 | NumAromaticRings: | 2 |
