Glycoside
GD074725
Name:
NoneFormula:
C18H26O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@H](C)c2ccc(C(N)=O)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C(=O)NCCO)c1ccc(C(N)=O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.15 | Num_rotatable_bonds: | 7 |
| MolWt: | 382.41 | Num_heavy_atoms: | 27 |
| TPSA: | 151.34 | NumAromaticRings: | 1 |
Unique Aglycone
AD34547
Formula: C12H16O3N2
Smiles:
CC(C(=O)NCCO)c1ccc(C(N)=O)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 236.27 | Num_heavy_atoms: | 17 |
| TPSA: | 92.42 | NumAromaticRings: | 1 |
