Glycoside
GD087845
Name:
NoneFormula:
C19H30O7N4Smiles:
CCOC(=O)CC1CCN(c2ccc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nn2)CC1Aglycone:
CCOC(=O)CC1CCN(c2ccc(N)nn2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.74 |
| AlogP: | -1.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 426.47 | Num_heavy_atoms: | 30 |
| TPSA: | 157.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD38523
Formula: C13H20O2N4
Smiles:
CCOC(=O)CC1CCN(c2ccc(N)nn2)CC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 264.33 | Num_heavy_atoms: | 19 |
| TPSA: | 81.34 | NumAromaticRings: | 1 |
