Glycoside
GD097876
Name:
NoneFormula:
C21H31O8N3Smiles:
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)[C@H]1c1cccnc1Aglycone:
CC(C)(C)OC(=O)N1CCC(CN)C1c1cccnc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 8 |
| MolWt: | 453.49 | Num_heavy_atoms: | 32 |
| TPSA: | 169.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD41640
Formula: C15H23O2N3
Smiles:
CC(C)(C)OC(=O)N1CCC(CN)C1c1cccnc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 277.37 | Num_heavy_atoms: | 20 |
| TPSA: | 68.45 | NumAromaticRings: | 1 |
