Glycoside
GD047051
Name:
NoneFormula:
C12H19O5N5Smiles:
Cn1ncc2c(=N)n(C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)cnc21Aglycone:
Cn1cnc2c(cnn2C)c1=NSugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -3.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 313.31 | Num_heavy_atoms: | 22 |
| TPSA: | 160.64 | NumAromaticRings: | 2 |
Unique Aglycone
AD25436
Formula: C7H9N5
Smiles:
Cn1cnc2c(cnn2C)c1=N| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 163.18 | Num_heavy_atoms: | 12 |
| TPSA: | 59.49 | NumAromaticRings: | 2 |
