Glycoside
GD010918
Name:
NoneFormula:
C26H31O9NSmiles:
O=C(O)[C@@H]1O[C@H](O[C@@H]2C=C[C@@H]3[C@@H]4Cc5ccc(O)c6c5C3(CCN4CC3CC3)[C@H]2O6)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1ccc2c3c1OC1C(O)C=CC4C(C2)N(CC2CC2)CCC341Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 501.53 | Num_heavy_atoms: | 36 |
| TPSA: | 149.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD08376
Formula: C20H23O3N
Smiles:
Oc1ccc2c3c1OC1C(O)C=CC4C(C2)N(CC2CC2)CCC341| HBA: | 4 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 2 |
| MolWt: | 325.41 | Num_heavy_atoms: | 24 |
| TPSA: | 52.93 | NumAromaticRings: | 1 |
