Glycoside
GD114602
Name:
2-{[4,6-diamino-3-({3-amino-6-[1-(methylamino)ethyl]oxan-2-yl}oxy)-2-fluorocyclohexyl]oxy}-5-methyl-4-(methylamino)oxane-3,5-diolFormula:
C21H42O6N5FSmiles:
CNC(C)C1CCC(N)C(OC2C(N)CC(N)C(OC3OCC(C)(O)C(NC)C3O)C2F)O1Aglycone:
CNC(C)C1CCC(N)C(OC2C(N)CC(N)C(O)C2F)O1Sugarmoiety:
CNC1C(O)C(O)OCC1(C)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 1.0 |
| AlogP: | -2.35 | Num_rotatable_bonds: | 7 |
| MolWt: | 479.59 | Num_heavy_atoms: | 33 |
| TPSA: | 179.5 | NumAromaticRings: | 0 |
Unique Aglycone
AD45156
Formula: C14H29O3N4F
Smiles:
CNC(C)C1CCC(N)C(OC2C(N)CC(N)C(O)C2F)O1| HBA: | 7 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 320.41 | Num_heavy_atoms: | 22 |
| TPSA: | 128.78 | NumAromaticRings: | 0 |
