Glycoside
GD047138
Name:
NoneFormula:
C11H14O5N4SSmiles:
OC[C@@H]1O[C@@H](Sc2ncnc3[nH]cnc23)[C@H](O)[C@H](O)[C@@H]1OAglycone:
Sc1ncnc2[nH]cnc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.32 | Num_heavy_atoms: | 21 |
| TPSA: | 144.61 | 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 |
