Glycoside
GD064901
Name:
NoneFormula:
C15H19O7N3Smiles:
NC(=O)c1ccc2c(n1)CCN(C(=O)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O)C2Aglycone:
NC(=O)c1ccc2c(n1)CCN(C=O)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -3.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 353.33 | Num_heavy_atoms: | 25 |
| TPSA: | 166.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD31234
Formula: C10H11O2N3
Smiles:
NC(=O)c1ccc2c(n1)CCN(C=O)C2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 2 |
| MolWt: | 205.22 | Num_heavy_atoms: | 15 |
| TPSA: | 76.29 | NumAromaticRings: | 1 |
