Glycoside
GD029131
Name:
NoneFormula:
C15H18O6N4Smiles:
O=C(N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1nnc(-c2ccccc2)[nH]1Aglycone:
NC(=O)c1nnc(-c2ccccc2)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 350.33 | Num_heavy_atoms: | 25 |
| TPSA: | 160.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD18987
Formula: C9H8ON4
Smiles:
NC(=O)c1nnc(-c2ccccc2)[nH]1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 188.19 | Num_heavy_atoms: | 14 |
| TPSA: | 84.66 | NumAromaticRings: | 2 |
