Glycoside
GD081304
Name:
NoneFormula:
C21H28O7N2Smiles:
O=C(C(=O)N1CCC2(CCC(=O)N2Cc2ccccc2)CC1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
O=C1CCC2(CCNCC2)N1Cc1ccccc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.46 | Num_heavy_atoms: | 30 |
| TPSA: | 138.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD36643
Formula: C15H20ON2
Smiles:
O=C1CCC2(CCNCC2)N1Cc1ccccc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.53 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.34 | Num_heavy_atoms: | 18 |
| TPSA: | 32.34 | NumAromaticRings: | 1 |
