Glycoside
GD070735
Name:
NoneFormula:
C19H28O5N2Smiles:
CCC(CC)C(=O)NC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)[C@H](O)[C@@H]1OAglycone:
CC(=O)Nc1ccccc1.CCC(CC)C(=O)NCSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 8 |
| MolWt: | 364.44 | Num_heavy_atoms: | 26 |
| TPSA: | 107.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD19580
Formula: C8H9ON
Smiles:
CC(=O)Nc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 135.17 | Num_heavy_atoms: | 10 |
| TPSA: | 29.1 | NumAromaticRings: | 1 |
AD29387
Formula: C7H15ON
Smiles:
CCC(CC)C(=O)NC| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 129.2 | Num_heavy_atoms: | 9 |
| TPSA: | 29.1 | NumAromaticRings: | 0 |
