Glycoside
GD071777
Name:
NoneFormula:
C19H29O6N2Smiles:
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC1C[NH+](Cc2ccccc2)CC1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.63 |
| AlogP: | -2.75 | Num_rotatable_bonds: | 5 |
| MolWt: | 381.45 | Num_heavy_atoms: | 27 |
| TPSA: | 123.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD33710
Formula: C13H19ON2
Smiles:
CC1C[NH+](Cc2ccccc2)CC1C(N)=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 219.31 | Num_heavy_atoms: | 16 |
| TPSA: | 47.53 | NumAromaticRings: | 1 |
