Glycoside
GD000504
Name:
NoneFormula:
C22H31O6N7Smiles:
Nc1cc(C(O)CNCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)ccc1OAglycone:
Nc1cc(C(O)CNCCCCNc2ncnc3c2N=C[N]3)ccc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.5 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 11 |
| MolWt: | 489.53 | Num_heavy_atoms: | 35 |
| TPSA: | 204.06 | NumAromaticRings: | 3 |
Unique Aglycone
AD00561
Formula: C17H22O2N7
Smiles:
Nc1cc(C(O)CNCCCCNc2ncnc3c2N=C[N]3)ccc1O| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 356.41 | Num_heavy_atoms: | 26 |
| TPSA: | 142.78 | NumAromaticRings: | 2 |
