Glycoside
GD066027
Name:
NoneFormula:
C15H22O8N2Smiles:
O=C1CC2(CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC2)CC(=O)N1Aglycone:
O=C1CC2(CCNCC2)CC(=O)N1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -3.32 | Num_rotatable_bonds: | 5 |
| MolWt: | 358.35 | Num_heavy_atoms: | 25 |
| TPSA: | 164.47 | NumAromaticRings: | 0 |
Unique Aglycone
AD31707
Formula: C9H14O2N2
Smiles:
O=C1CC2(CCNCC2)CC(=O)N1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 182.22 | Num_heavy_atoms: | 13 |
| TPSA: | 58.2 | NumAromaticRings: | 0 |
