Glycoside
GD053864
Name:
NoneFormula:
C16H24O7NSmiles:
COc1cccc2c1C[C@@H]([NH2+][C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)CO2Aglycone:
COc1cccc2c1CC([NH3+])CO2Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 342.37 | Num_heavy_atoms: | 24 |
| TPSA: | 125.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD27447
Formula: C10H14O2N
Smiles:
COc1cccc2c1CC([NH3+])CO2| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.23 | Num_heavy_atoms: | 13 |
| TPSA: | 46.1 | NumAromaticRings: | 1 |
