Glycoside
GD143630
Name:
2-[(2,4-diamino-5-{[3-amino-6-(1-aminoethyl)oxan-2-yl]oxy}cyclohexyl)oxy]-5-methyl-4-(methylamino)oxane-3,5-diolFormula:
C20H41O6N5Smiles:
CNC1C(O)C(OC2CC(OC3OC(C(C)N)CCC3N)C(N)CC2N)OCC1(C)OAglycone:
CC(N)C1CCC(N)C(OC2CC(O)C(N)CC2N)O1Sugarmoiety:
CNC1C(O)C(O)OCC1(C)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 1.0 |
| AlogP: | -2.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 447.58 | Num_heavy_atoms: | 31 |
| TPSA: | 193.49 | NumAromaticRings: | 0 |
Unique Aglycone
AD57758
Formula: C13H28O3N4
Smiles:
CC(N)C1CCC(N)C(OC2CC(O)C(N)CC2N)O1| HBA: | 7 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 1.0 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.39 | Num_heavy_atoms: | 20 |
| TPSA: | 142.77 | NumAromaticRings: | 0 |
