Glycoside
GD053192
Name:
NoneFormula:
C12H14O6N4SSmiles:
COC(=O)[C@H]1O[C@@H](Sc2ncnc3[nH]cnc23)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Sc1ncnc2[nH]cnc12Sugarmoiety:
COC(=O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 342.33 | Num_heavy_atoms: | 23 |
| TPSA: | 150.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD25286
Formula: C5H4N4S
Smiles:
Sc1ncnc2[nH]cnc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 0 |
| MolWt: | 152.18 | Num_heavy_atoms: | 10 |
| TPSA: | 54.46 | NumAromaticRings: | 2 |
