Glycoside
GD096014
Name:
NoneFormula:
C22H30O9N2Smiles:
CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)CSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 466.49 | Num_heavy_atoms: | 33 |
| TPSA: | 170.57 | NumAromaticRings: | 2 |
Unique Aglycone
AD40822
Formula: C17H22O4N2
Smiles:
COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.41 |
| AlogP: | 2.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.37 | Num_heavy_atoms: | 23 |
| TPSA: | 80.42 | NumAromaticRings: | 2 |
