Glycoside
GD057758
Name:
NoneFormula:
C16H25O6N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccccc2C[NH3+])[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]Cc1ccccc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.56 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 6 |
| MolWt: | 341.38 | Num_heavy_atoms: | 24 |
| TPSA: | 135.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD28990
Formula: C10H15O2N2
Smiles:
[NH3+]Cc1ccccc1C(=O)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 195.24 | Num_heavy_atoms: | 14 |
| TPSA: | 76.97 | NumAromaticRings: | 1 |
