Glycoside
GD081501
Name:
NoneFormula:
C20H29O7N3Smiles:
O=C(CN1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC1)NCCc1ccccc1Aglycone:
O=C(CN1CCNCC1)NCCc1ccccc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -2.87 | Num_rotatable_bonds: | 10 |
| MolWt: | 423.47 | Num_heavy_atoms: | 30 |
| TPSA: | 150.64 | NumAromaticRings: | 1 |
Unique Aglycone
AD36692
Formula: C14H21ON3
Smiles:
O=C(CN1CCNCC1)NCCc1ccccc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 247.34 | Num_heavy_atoms: | 18 |
| TPSA: | 44.37 | NumAromaticRings: | 1 |
