Glycoside
GD155257
Name:
Fattiviracin Fv-4Formula:
C68H124O28Smiles:
CC(O)CCCCCC(CCCCCCCCCCCC1CC(=O)OCC2OC(OC(CCCCCCCCCCCC(CCCCCC(C)O)OC3OC(CO)C(O)C(O)C3O)CC(=O)OCC3OC(O1)C(O)C(O)C3O)C(O)C(O)C2O)OC1OC(CO)C(O)C(O)C1OAglycone:
CC(O)CCCCCC(O)CCCCCCCCCCCC1CC(=O)OCC2OC(OC(CCCCCCCCCCCC(O)CCCCCC(C)O)CC(=O)OCC3OC(O1)C(O)C(O)C3O)C(O)C(O)C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 28 | RingCount: | 5 |
| HBD: | 16 | FractionCSP3: | 0.97 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 42 |
| MolWt: | 1389.71 | Num_heavy_atoms: | 96 |
| TPSA: | 450.12 | NumAromaticRings: | 0 |
Unique Aglycone
AD61597
Formula: C56H104O18
Smiles:
CC(O)CCCCCC(O)CCCCCCCCCCCC1CC(=O)OCC2OC(OC(CCCCCCCCCCCC(O)CCCCCC(C)O)CC(=O)OCC3OC(O1)C(O)C(O)C3O)C(O)C(O)C2O| HBA: | 18 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.96 |
| AlogP: | 6.22 | Num_rotatable_bonds: | 36 |
| MolWt: | 1065.43 | Num_heavy_atoms: | 74 |
| TPSA: | 291.82 | NumAromaticRings: | 0 |
