Glycoside
GD071647
Name:
NoneFormula:
C20H29O6N2Smiles:
O=C(C(=O)N1CCC([N@H+]2CCc3ccccc3C2)CC1)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
c1ccc2c(c1)CC[NH+](C1CCNCC1)C2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -2.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 393.46 | Num_heavy_atoms: | 28 |
| TPSA: | 122.74 | NumAromaticRings: | 1 |
Unique Aglycone
AD33652
Formula: C14H21N2
Smiles:
c1ccc2c(c1)CC[NH+](C1CCNCC1)C2| HBA: | 2 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 217.34 | Num_heavy_atoms: | 16 |
| TPSA: | 16.47 | NumAromaticRings: | 1 |
