Glycoside
GD056308
Name:
NoneFormula:
C14H19O7N3Smiles:
NC(=O)c1cc2c([nH]1)CN(C(=O)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O)CC2Aglycone:
NC(=O)c1cc2c([nH]1)CN(C=O)CC2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.57 |
| AlogP: | -3.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 341.32 | Num_heavy_atoms: | 24 |
| TPSA: | 169.34 | NumAromaticRings: | 1 |
Unique Aglycone
AD28326
Formula: C9H11O2N3
Smiles:
NC(=O)c1cc2c([nH]1)CN(C=O)CC2| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 193.21 | Num_heavy_atoms: | 14 |
| TPSA: | 79.19 | NumAromaticRings: | 1 |
