Glycoside
GD080937
Name:
NoneFormula:
C12H18O6N6S2Smiles:
CN(C)S(=O)(=O)Nc1[nH]c(=S)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CN(C)S(=O)(=O)Nc1[nH]c(=S)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.45 | Num_heavy_atoms: | 26 |
| TPSA: | 165.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD36540
Formula: C7H9O2N6S2
Smiles:
CN(C)S(=O)(=O)Nc1[nH]c(=S)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 273.32 | Num_heavy_atoms: | 17 |
| TPSA: | 104.55 | NumAromaticRings: | 1 |
