Glycoside
GD094922
Name:
NoneFormula:
C19H23O8N5SSmiles:
CC(=O)N1CCc2cc(S(=O)(=O)Nc3c(C(N)=O)ncn3[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc21Aglycone:
CC(=O)N1CCc2cc(S(=O)(=O)NC3=C(C(N)=O)N=C[N]3)ccc21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -1.7 | Num_rotatable_bonds: | 6 |
| MolWt: | 481.49 | Num_heavy_atoms: | 33 |
| TPSA: | 197.31 | NumAromaticRings: | 2 |
Unique Aglycone
AD40562
Formula: C14H14O4N5S
Smiles:
CC(=O)N1CCc2cc(S(=O)(=O)NC3=C(C(N)=O)N=C[N]3)ccc21| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.21 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.36 | Num_heavy_atoms: | 24 |
| TPSA: | 136.03 | NumAromaticRings: | 1 |
