Glycoside
GD034861
Name:
NoneFormula:
C20H24O5N6Smiles:
OC[C@@H]1O[C@H](n2cnc3c(Nc4ccc(N5CCOCC5)cc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2Nc2ccc(N3CCOCC3)cc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 428.45 | Num_heavy_atoms: | 31 |
| TPSA: | 138.02 | NumAromaticRings: | 3 |
Unique Aglycone
AD22107
Formula: C15H15ON6
Smiles:
C1=Nc2c(ncnc2Nc2ccc(N3CCOCC3)cc2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 1.97 | Num_rotatable_bonds: | 3 |
| MolWt: | 295.33 | Num_heavy_atoms: | 22 |
| TPSA: | 76.74 | NumAromaticRings: | 2 |
