Glycoside
GD092055
Name:
NoneFormula:
C23H29O6N2Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)C1C[NH+](C(c2ccccc2)c2ccccc2)C1Aglycone:
NC(=O)C1C[NH+](C(c2ccccc2)c2ccccc2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 6 |
| MolWt: | 429.49 | Num_heavy_atoms: | 31 |
| TPSA: | 123.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD40183
Formula: C17H19ON2
Smiles:
NC(=O)C1C[NH+](C(c2ccccc2)c2ccccc2)C1| HBA: | 3 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.24 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 267.35 | Num_heavy_atoms: | 20 |
| TPSA: | 47.53 | NumAromaticRings: | 2 |
