Glycoside
GD072822
Name:
NoneFormula:
C19H27O8NSmiles:
COc1cccc(OCC2CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC2)c1Aglycone:
COc1cccc(OCC2CCNCC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 9 |
| MolWt: | 397.42 | Num_heavy_atoms: | 28 |
| TPSA: | 136.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD33887
Formula: C13H19O2N
Smiles:
COc1cccc(OCC2CCNCC2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 221.3 | Num_heavy_atoms: | 16 |
| TPSA: | 30.49 | NumAromaticRings: | 1 |
