Glycoside
GD064310
Name:
NoneFormula:
C15H22O6N4Smiles:
O=C([C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1C[C@@H]2C[C@H](C1)N2Cc1ncc[nH]1Aglycone:
O=CN1CC2CC(C1)N2Cc1ncc[nH]1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -3.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 354.36 | Num_heavy_atoms: | 25 |
| TPSA: | 142.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD30949
Formula: C10H14ON4
Smiles:
O=CN1CC2CC(C1)N2Cc1ncc[nH]1| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 206.25 | Num_heavy_atoms: | 15 |
| TPSA: | 52.23 | NumAromaticRings: | 1 |
