Glycoside
GD063186
Name:
NoneFormula:
C14H21O6N5Smiles:
O=C([C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1C[C@@H]2C[C@H](C1)N2Cc1c[nH]nn1Aglycone:
O=CN1CC2CC(C1)N2Cc1c[nH]nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| 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
AD30458
Formula: C9H13ON5
Smiles:
O=CN1CC2CC(C1)N2Cc1c[nH]nn1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 207.24 | Num_heavy_atoms: | 15 |
| TPSA: | 65.12 | NumAromaticRings: | 1 |
