Glycoside
GD016366
Name:
NoneFormula:
C21H23O5N9Smiles:
CCNC(=O)c1cnn(-c2nc(Nc3ccncc3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
CCNC(=O)c1cnn(-c2nc3c(c(Nc4ccncc4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 7 |
| MolWt: | 481.47 | Num_heavy_atoms: | 35 |
| TPSA: | 185.36 | NumAromaticRings: | 4 |
Unique Aglycone
AD11797
Formula: C16H14ON9
Smiles:
CCNC(=O)c1cnn(-c2nc3c(c(Nc4ccncc4)n2)N=C[N]3)c1| HBA: | 10 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.35 | Num_heavy_atoms: | 26 |
| TPSA: | 124.08 | NumAromaticRings: | 3 |
