Glycoside
GD003749
Name:
NoneFormula:
C21H23O8NSmiles:
O=C(c1ccccc1)c1ccc2n1CC[C@H]2C(=O)OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)C1CCn2c(C(=O)c3ccccc3)ccc21Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 417.41 | Num_heavy_atoms: | 30 |
| TPSA: | 138.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD03361
Formula: C16H15O3N
Smiles:
COC(=O)C1CCn2c(C(=O)c3ccccc3)ccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.3 | Num_heavy_atoms: | 20 |
| TPSA: | 48.3 | NumAromaticRings: | 2 |
