Glycoside
GD077685
Name:
NoneFormula:
C17H21O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCCCc4ccco4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCCCc2ccco2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 375.39 | Num_heavy_atoms: | 27 |
| TPSA: | 138.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD35563
Formula: C12H12ON5
Smiles:
C1=Nc2c(ncnc2NCCCc2ccco2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 242.26 | Num_heavy_atoms: | 18 |
| TPSA: | 77.41 | NumAromaticRings: | 2 |
