Glycoside
GD066718
Name:
NoneFormula:
C14H22O9N2Smiles:
O=C(CO)N1C[C@H]2CN(C(=O)[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)C[C@@H](C1)O2Aglycone:
O=CN1CC2CN(C(=O)CO)CC(C1)O2Sugarmoiety:
OC1OOC(O)C(O)C1O.OCOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -4.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 362.34 | Num_heavy_atoms: | 25 |
| TPSA: | 160.23 | NumAromaticRings: | 0 |
Unique Aglycone
AD31906
Formula: C9H14O4N2
Smiles:
O=CN1CC2CN(C(=O)CO)CC(C1)O2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 214.22 | Num_heavy_atoms: | 15 |
| TPSA: | 70.08 | NumAromaticRings: | 0 |
