Glycoside
GD098557
Name:
NoneFormula:
C22H32O9N2Smiles:
COc1ccc2c(c1)CCN(C(=O)OC(C)(C)C)[C@H]2C(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COc1ccc2c(c1)CCN(C(=O)OC(C)(C)C)C2C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 468.5 | Num_heavy_atoms: | 33 |
| TPSA: | 158.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD41910
Formula: C16H22O4N2
Smiles:
COc1ccc2c(c1)CCN(C(=O)OC(C)(C)C)C2C(N)=O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 306.36 | Num_heavy_atoms: | 22 |
| TPSA: | 81.86 | NumAromaticRings: | 1 |
