Glycoside
GD157998
Name:
5-amino-6-{[3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}cyclohexane-1,2,3,4-tetrolFormula:
C12H25O8N3Smiles:
NCC1OC(OC2C(N)C(O)C(O)C(O)C2O)C(N)C(O)C1OAglycone:
NC1C(O)C(O)C(O)C(O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 12 | FractionCSP3: | 1.0 |
| AlogP: | -6.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 339.35 | Num_heavy_atoms: | 23 |
| TPSA: | 217.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD13160
Formula: C6H13O5N
Smiles:
NC1C(O)C(O)C(O)C(O)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -3.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 179.17 | Num_heavy_atoms: | 12 |
| TPSA: | 127.17 | NumAromaticRings: | 0 |
