Glycoside
GD082109
Name:
NoneFormula:
C20H28O7N2Smiles:
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CC(=O)N1Cc2ccccc2CC1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.45 | Num_heavy_atoms: | 29 |
| TPSA: | 128.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD36869
Formula: C14H18O3N2
Smiles:
CC(=O)N1Cc2ccccc2CC1C(=O)NCCO| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 262.31 | Num_heavy_atoms: | 19 |
| TPSA: | 69.64 | NumAromaticRings: | 1 |
