Glycoside
GD044491
Name:
NoneFormula:
C12H19O5N2Smiles:
Cc1ccc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)[nH+]c1Aglycone:
Cc1ccc(N)[nH+]c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 271.29 | Num_heavy_atoms: | 19 |
| TPSA: | 116.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD25037
Formula: C6H9N2
Smiles:
Cc1ccc(N)[nH+]c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 0 |
| MolWt: | 109.15 | Num_heavy_atoms: | 8 |
| TPSA: | 40.16 | NumAromaticRings: | 1 |
