Glycoside
GD021559
Name:
NoneFormula:
C20H42O6N4Smiles:
CCCCO[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H](CN)[C@H](O)[C@H](OCCCC)[C@H]2N)[C@@H](N)C[C@H]1NAglycone:
CCCCO.CCCCOC1C(N)CC(N)C(O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 10 | FractionCSP3: | 1.0 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 11 |
| MolWt: | 434.58 | Num_heavy_atoms: | 30 |
| TPSA: | 181.46 | NumAromaticRings: | 0 |
Unique Aglycone
AD00936
Formula: C4H10O
Smiles:
CCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 74.12 | Num_heavy_atoms: | 5 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
AD14729
Formula: C10H22O3N2
Smiles:
CCCCOC1C(N)CC(N)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 218.3 | Num_heavy_atoms: | 15 |
| TPSA: | 101.73 | NumAromaticRings: | 0 |
