Glycoside
GD063187
Name:
NoneFormula:
C14H21O6N5Smiles:
O=C([C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1CCC12CN(Cc1c[nH]nn1)C2Aglycone:
O=CN1CCC12CN(Cc1c[nH]nn1)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | -3.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 355.35 | Num_heavy_atoms: | 25 |
| TPSA: | 155.27 | NumAromaticRings: | 1 |
Unique Aglycone
AD30460
Formula: C9H13ON5
Smiles:
O=CN1CCC12CN(Cc1c[nH]nn1)C2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 207.24 | Num_heavy_atoms: | 15 |
| TPSA: | 65.12 | NumAromaticRings: | 1 |
