Glycoside
GD079433
Name:
NoneFormula:
C16H22O7N4SSmiles:
O=S(=O)(Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1Aglycone:
O=S(=O)(Nc1ncnc2c1C=C[N]2)C1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 414.44 | Num_heavy_atoms: | 28 |
| TPSA: | 156.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD36319
Formula: C11H13O3N4S
Smiles:
O=S(=O)(Nc1ncnc2c1C=C[N]2)C1CCOCC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 281.32 | Num_heavy_atoms: | 19 |
| TPSA: | 95.28 | NumAromaticRings: | 1 |
