Glycoside
GD007646
Name:
NoneFormula:
C24H23O10NSmiles:
O=C(O)CCc1nc(-c2ccc(OC3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)cc2)c(-c2ccccc2)o1Aglycone:
O=C(O)CCc1nc(-c2ccc(O)cc2)c(-c2ccccc2)o1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 8 |
| MolWt: | 485.45 | Num_heavy_atoms: | 35 |
| TPSA: | 179.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD06202
Formula: C18H15O4N
Smiles:
O=C(O)CCc1nc(-c2ccc(O)cc2)c(-c2ccccc2)o1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 3.73 | Num_rotatable_bonds: | 5 |
| MolWt: | 309.32 | Num_heavy_atoms: | 23 |
| TPSA: | 83.56 | NumAromaticRings: | 3 |
