Glycoside
GD008715
Name:
NoneFormula:
C25H29O9NSmiles:
C=CCN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@H](O[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)C=C[C@H]3[C@H]1C5Aglycone:
C=CCN1CCC23c4c5ccc(O)c4OC2C(O)C=CC3C1C5Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 487.51 | Num_heavy_atoms: | 35 |
| TPSA: | 149.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD06927
Formula: C19H21O3N
Smiles:
C=CCN1CCC23c4c5ccc(O)c4OC2C(O)C=CC3C1C5| HBA: | 4 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 311.38 | Num_heavy_atoms: | 23 |
| TPSA: | 52.93 | NumAromaticRings: | 1 |
