Glycoside
GD152181
Name:
5-amino-6-[(6-amino-2-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3-hydroxy-4-(methylamino)cyclohexyl)oxy]-2-(aminomethyl)oxane-3,4-diolFormula:
C18H36O10N4Smiles:
CNC1CC(N)C(OC2OC(CN)C(O)C(O)C2N)C(OC2OC(CO)C(O)C2O)C1OAglycone:
CNC1CC(N)C(O)C(O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 1.0 |
| AlogP: | -6.39 | Num_rotatable_bonds: | 7 |
| MolWt: | 468.5 | Num_heavy_atoms: | 32 |
| TPSA: | 248.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD51267
Formula: C7H16O3N2
Smiles:
CNC1CC(N)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 1 |
| MolWt: | 176.22 | Num_heavy_atoms: | 12 |
| TPSA: | 98.74 | NumAromaticRings: | 0 |
