Glycoside
GD064785
Name:
NoneFormula:
C16H23O6N3Smiles:
O=C(C(=O)N1CC2(CN(Cc3ccc[nH]3)C2)C1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
c1c[nH]c(CN2CC3(CNC3)C2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 7 |
| MolWt: | 353.38 | Num_heavy_atoms: | 25 |
| TPSA: | 137.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD31187
Formula: C10H15N3
Smiles:
c1c[nH]c(CN2CC3(CNC3)C2)c1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 177.25 | Num_heavy_atoms: | 13 |
| TPSA: | 31.06 | NumAromaticRings: | 1 |
