Glycoside
GD037184
Name:
NoneFormula:
C20H24O10N6SSmiles:
COc1cc(NS(=O)(=O)c2ccc(-n3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)nn3)cc2)nc(OC)n1Aglycone:
COc1cc(NS(=O)(=O)c2ccc(-n3cc(O)nn3)cc2)nc(OC)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 9 |
| MolWt: | 540.51 | Num_heavy_atoms: | 37 |
| TPSA: | 220.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD23437
Formula: C14H14O5N6S
Smiles:
COc1cc(NS(=O)(=O)c2ccc(-n3cc(O)nn3)cc2)nc(OC)n1| HBA: | 11 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 6 |
| MolWt: | 378.37 | Num_heavy_atoms: | 26 |
| TPSA: | 141.35 | NumAromaticRings: | 3 |
