Glycoside
GD023177
Name:
NoneFormula:
C32H33O11NSmiles:
COc1cccc(-c2cc(C(=O)Nc3cc4cc(OC)c(O[C@@H]5O[C@H](CO)C[C@H](O)[C@H]5O)c(C)c4oc3=O)ccc2OC)c1Aglycone:
COc1cccc(-c2cc(C(=O)Nc3cc4cc(OC)c(O)c(C)c4oc3=O)ccc2OC)c1Sugarmoiety:
OCC1CC(O)C(O)C(O)O1Other Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.31 |
| AlogP: | 3.25 | Num_rotatable_bonds: | 9 |
| MolWt: | 607.61 | Num_heavy_atoms: | 44 |
| TPSA: | 166.15 | NumAromaticRings: | 4 |
Unique Aglycone
AD01180
Formula: C26H23O7N
Smiles:
COc1cccc(-c2cc(C(=O)Nc3cc4cc(OC)c(O)c(C)c4oc3=O)ccc2OC)c1| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 4.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 461.47 | Num_heavy_atoms: | 34 |
| TPSA: | 107.23 | NumAromaticRings: | 4 |
