Glycoside
GD073110
Name:
NoneFormula:
C19H27O8NSmiles:
COc1ccccc1C1(CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CCOCC1Aglycone:
COc1ccccc1C1(CN)CCOCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 9 |
| MolWt: | 397.42 | Num_heavy_atoms: | 28 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD33960
Formula: C13H19O2N
Smiles:
COc1ccccc1C1(CN)CCOCC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 221.3 | Num_heavy_atoms: | 16 |
| TPSA: | 44.48 | NumAromaticRings: | 1 |
