Glycoside
GD080881
Name:
NoneFormula:
C18H28O7N4Smiles:
CCOC(=O)[C@H]1CCCN(c2ccc(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nn2)C1Aglycone:
CCOC(=O)C1CCCN(c2ccc(N)nn2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 412.44 | Num_heavy_atoms: | 29 |
| TPSA: | 157.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD36516
Formula: C12H18O2N4
Smiles:
CCOC(=O)C1CCCN(c2ccc(N)nn2)C1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 250.3 | Num_heavy_atoms: | 18 |
| TPSA: | 81.34 | NumAromaticRings: | 1 |
