Glycoside
GD083313
Name:
NoneFormula:
C21H33O6N2Smiles:
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CC1C[NH+](Cc2ccccc2)CC1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.7 | Num_rotatable_bonds: | 7 |
| MolWt: | 409.5 | Num_heavy_atoms: | 29 |
| TPSA: | 112.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD37204
Formula: C15H23O2N2
Smiles:
CC1C[NH+](Cc2ccccc2)CC1C(=O)NCCO| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 263.36 | Num_heavy_atoms: | 19 |
| TPSA: | 53.77 | NumAromaticRings: | 1 |
