Glycoside
GD077845
Name:
NoneFormula:
C18H18O5N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCc4noc5ccccc45)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCc2noc3ccccc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 398.38 | Num_heavy_atoms: | 29 |
| TPSA: | 151.58 | NumAromaticRings: | 4 |
Unique Aglycone
AD35656
Formula: C13H9ON6
Smiles:
C1=Nc2c(ncnc2NCc2noc3ccccc23)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 265.26 | Num_heavy_atoms: | 20 |
| TPSA: | 90.3 | NumAromaticRings: | 3 |
