Glycoside
GD122080
Name:
Validamycin GFormula:
C20H35O14NSmiles:
OCC1=CC(NC2CC(O)(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OAglycone:
OCC1=CC(NC2CC(O)(CO)C(O)C(O)C2O)C(O)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 0.9 |
| AlogP: | -7.64 | Num_rotatable_bonds: | 7 |
| MolWt: | 513.49 | Num_heavy_atoms: | 35 |
| TPSA: | 273.25 | NumAromaticRings: | 0 |
Unique Aglycone
AD49176
Formula: C14H25O9N
Smiles:
OCC1=CC(NC2CC(O)(CO)C(O)C(O)C2O)C(O)C(O)C1O| HBA: | 10 | RingCount: | 2 |
| HBD: | 10 | FractionCSP3: | 0.86 |
| AlogP: | -5.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 351.35 | Num_heavy_atoms: | 24 |
| TPSA: | 194.1 | NumAromaticRings: | 0 |
