Glycoside
GD058407
Name:
NoneFormula:
C17H26O6NSmiles:
COc1cccc2c1CC[C@@H]([NH2+][C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)C2Aglycone:
COc1cccc2c1CCC([NH3+])C2Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.59 |
| AlogP: | -2.24 | Num_rotatable_bonds: | 8 |
| MolWt: | 340.4 | Num_heavy_atoms: | 24 |
| TPSA: | 123.83 | 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 |
