Glycoside
GD057995
Name:
NoneFormula:
C17H26O6NSmiles:
COc1cccc2c1CC[C@@H]([NH2+][C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)C2Aglycone:
COc1cccc2c1CCC([NH3+])C2Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -2.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 340.4 | Num_heavy_atoms: | 24 |
| TPSA: | 115.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD29085
Formula: C11H16ON
Smiles:
COc1cccc2c1CCC([NH3+])C2| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.25 | Num_heavy_atoms: | 13 |
| TPSA: | 36.87 | NumAromaticRings: | 1 |
