Glycoside
GD101078
Name:
NoneFormula:
C21H32O9N2Smiles:
COc1ccc(NC(=O)OC(C)(C)C)c(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c1Aglycone:
COc1ccc(NC(=O)OC(C)(C)C)c(C(=O)NCCO)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 7 |
| MolWt: | 456.49 | Num_heavy_atoms: | 32 |
| TPSA: | 155.81 | NumAromaticRings: | 1 |
Unique Aglycone
AD42723
Formula: C15H22O5N2
Smiles:
COc1ccc(NC(=O)OC(C)(C)C)c(C(=O)NCCO)c1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 5 |
| MolWt: | 310.35 | Num_heavy_atoms: | 22 |
| TPSA: | 96.89 | NumAromaticRings: | 1 |
