Glycoside
GD082536
Name:
NoneFormula:
C18H22O7N4Smiles:
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c2cc1CAglycone:
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C)c2cc1CSugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 406.4 | Num_heavy_atoms: | 29 |
| TPSA: | 181.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD07263
Formula: C13H12O2N4
Smiles:
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C)c2cc1C| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.23 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 256.26 | Num_heavy_atoms: | 19 |
| TPSA: | 80.64 | NumAromaticRings: | 1 |
