Glycoside
GD119657
Name:
N-(5-amino-2-{[3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-3-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4-hydroxycyclohexyl)acetamideFormula:
C19H36O11N4Smiles:
CC(O)=NC1CC(N)C(O)C(OC2OC(CO)C(O)C2O)C1OC1OC(CN)C(O)C(O)C1NAglycone:
CC(O)=NC1CC(N)C(O)C(O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 0.95 |
| AlogP: | -5.63 | Num_rotatable_bonds: | 7 |
| MolWt: | 496.51 | Num_heavy_atoms: | 34 |
| TPSA: | 268.95 | NumAromaticRings: | 0 |
Unique Aglycone
AD47980
Formula: C8H16O4N2
Smiles:
CC(O)=NC1CC(N)C(O)C(O)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -1.85 | Num_rotatable_bonds: | 1 |
| MolWt: | 204.23 | Num_heavy_atoms: | 14 |
| TPSA: | 119.3 | NumAromaticRings: | 0 |
