Glycoside
GD049753
Name:
NoneFormula:
C12H17O7N3Smiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cc2n(n1)CCO2Aglycone:
NC(=O)c1cc2n(n1)CCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -3.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 315.28 | Num_heavy_atoms: | 22 |
| TPSA: | 146.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD26330
Formula: C6H7O2N3
Smiles:
NC(=O)c1cc2n(n1)CCO2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 1 |
| MolWt: | 153.14 | Num_heavy_atoms: | 11 |
| TPSA: | 70.14 | NumAromaticRings: | 1 |
