Glycoside
GD129100
Name:
2-{[4,6-diamino-3-({3-amino-6-[(dimethylamino)methyl]oxan-2-yl}oxy)-2-hydroxycyclohexyl]oxy}-5-methyl-4-(methylamino)oxane-3,5-diolFormula:
C21H43O7N5Smiles:
CNC1C(O)C(OC2C(N)CC(N)C(OC3OC(CN(C)C)CCC3N)C2O)OCC1(C)OAglycone:
CN(C)CC1CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1Sugarmoiety:
CNC1C(O)C(O)OCC1(C)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 1.0 |
| AlogP: | -3.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 477.6 | Num_heavy_atoms: | 33 |
| TPSA: | 190.94 | NumAromaticRings: | 0 |
Unique Aglycone
AD52288
Formula: C14H30O4N4
Smiles:
CN(C)CC1CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1| HBA: | 8 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | -2.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.42 | Num_heavy_atoms: | 22 |
| TPSA: | 140.22 | NumAromaticRings: | 0 |
