Glycoside
GD019249
Name:
NoneFormula:
C19H27O6N3Smiles:
CC(C)c1[nH]nc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(N)cc1Aglycone:
CC(C)c1[nH]nc(O)c1Cc1ccc(N)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.53 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 393.44 | Num_heavy_atoms: | 28 |
| TPSA: | 154.08 | NumAromaticRings: | 2 |
Unique Aglycone
AD13459
Formula: C13H17ON3
Smiles:
CC(C)c1[nH]nc(O)c1Cc1ccc(N)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.31 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 231.3 | Num_heavy_atoms: | 17 |
| TPSA: | 74.93 | NumAromaticRings: | 2 |
