Glycoside
GD065354
Name:
NoneFormula:
C15H22O8N2Smiles:
CN1C(=O)C[C@]2(CCCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C2)C1=OAglycone:
CN1C(=O)CC2(CCCNC2)C1=OSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -3.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 358.35 | Num_heavy_atoms: | 25 |
| TPSA: | 155.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD31433
Formula: C9H14O2N2
Smiles:
CN1C(=O)CC2(CCCNC2)C1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 0 |
| MolWt: | 182.22 | Num_heavy_atoms: | 13 |
| TPSA: | 49.41 | NumAromaticRings: | 0 |
