Glycoside
GD103891
Name:
NoneFormula:
C24H35O8N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C[C@H](Cc2ccccc2C#N)NC(=O)OC(C)(C)C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)NC(CC(=O)NCCO)Cc1ccccc1C#NSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 9 |
| MolWt: | 493.56 | Num_heavy_atoms: | 35 |
| TPSA: | 170.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD43923
Formula: C18H25O4N3
Smiles:
CC(C)(C)OC(=O)NC(CC(=O)NCCO)Cc1ccccc1C#N| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 7 |
| MolWt: | 347.42 | Num_heavy_atoms: | 25 |
| TPSA: | 111.45 | NumAromaticRings: | 1 |
