Glycoside
GD018072
Name:
NoneFormula:
C20H42O6N12Smiles:
CO[C@@H]1[C@@H](O[C@@H]2O[C@H](CN=C(N)N)[C@H](OC)[C@H](OC)[C@H]2N=C(N)N)[C@@H](N=C(N)N)C[C@@H](N=C(N)N)[C@H]1OCAglycone:
CN=C(N)N.COC1C(N=C(N)N)CC(N=C(N)N)C(O)C1OCSugarmoiety:
COC1C(O)OC(O)C(N=C(N)N)C1OCOther Identifiers
Properties
| HBA: | 18 | RingCount: | 2 |
| HBD: | 16 | FractionCSP3: | 0.8 |
| AlogP: | -5.24 | Num_rotatable_bonds: | 11 |
| MolWt: | 546.63 | Num_heavy_atoms: | 38 |
| TPSA: | 312.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD02806
Formula: C2H7N3
Smiles:
CN=C(N)N| HBA: | 3 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 0 |
| MolWt: | 73.1 | Num_heavy_atoms: | 5 |
| TPSA: | 64.4 | NumAromaticRings: | 0 |
AD12811
Formula: C10H22O3N6
Smiles:
COC1C(N=C(N)N)CC(N=C(N)N)C(O)C1OC| HBA: | 9 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.8 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 4 |
| MolWt: | 274.33 | Num_heavy_atoms: | 19 |
| TPSA: | 167.49 | NumAromaticRings: | 0 |
