Glycoside
GD102590
Name:
NoneFormula:
C22H32O8N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2Cc3ccccc3N2C(=O)OC(C)(C)C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1c2ccccc2CC1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 452.5 | Num_heavy_atoms: | 32 |
| TPSA: | 137.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD43427
Formula: C16H22O4N2
Smiles:
CC(C)(C)OC(=O)N1c2ccccc2CC1C(=O)NCCO| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 306.36 | Num_heavy_atoms: | 22 |
| TPSA: | 78.87 | NumAromaticRings: | 1 |
