Glycoside
GD081316
Name:
NoneFormula:
C18H28O7N4Smiles:
CC(=O)N1CCC(Cn2ncc(C)c2NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC1Aglycone:
CC(=O)N1CCC(Cn2ncc(C)c2N)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.97 | Num_rotatable_bonds: | 8 |
| MolWt: | 412.44 | Num_heavy_atoms: | 29 |
| TPSA: | 165.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD36642
Formula: C12H20ON4
Smiles:
CC(=O)N1CCC(Cn2ncc(C)c2N)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 2 |
| MolWt: | 236.32 | Num_heavy_atoms: | 17 |
| TPSA: | 64.15 | NumAromaticRings: | 1 |
