Glycoside
GD071659
Name:
NoneFormula:
C18H31O6N4Smiles:
CC(C)[N@H+](C)Cc1cnc2n1CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)[C@@H]2CAglycone:
CC1NCCn2c(C[NH+](C)C(C)C)cnc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | -3.15 | Num_rotatable_bonds: | 8 |
| MolWt: | 399.47 | Num_heavy_atoms: | 28 |
| TPSA: | 140.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD33655
Formula: C12H23N4
Smiles:
CC1NCCn2c(C[NH+](C)C(C)C)cnc21| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 3 |
| MolWt: | 223.34 | Num_heavy_atoms: | 16 |
| TPSA: | 34.29 | NumAromaticRings: | 1 |
