Glycoside
GD057642
Name:
NoneFormula:
C14H24O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@H]2CC(=O)N(C)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CN1CC(C(=O)NCCO)CC1=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | -2.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 332.35 | Num_heavy_atoms: | 23 |
| TPSA: | 128.56 | NumAromaticRings: | 0 |
Unique Aglycone
AD28921
Formula: C8H14O3N2
Smiles:
CN1CC(C(=O)NCCO)CC1=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 186.21 | Num_heavy_atoms: | 13 |
| TPSA: | 69.64 | NumAromaticRings: | 0 |
