Glycoside
GD102416
Name:
NoneFormula:
C19H23O6N5S2Smiles:
CC(C)c1cccc(S(=O)(=O)Nc2[nH]c(=S)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
CC(C)c1cccc(S(=O)(=O)Nc2[nH]c(=S)nc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 481.56 | Num_heavy_atoms: | 32 |
| TPSA: | 162.59 | NumAromaticRings: | 3 |
Unique Aglycone
AD43347
Formula: C14H14O2N5S2
Smiles:
CC(C)c1cccc(S(=O)(=O)Nc2[nH]c(=S)nc3c2N=C[N]3)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.43 | Num_heavy_atoms: | 23 |
| TPSA: | 101.31 | NumAromaticRings: | 2 |
