Glycoside
GD088664
Name:
NoneFormula:
C16H24O5N6S2Smiles:
C[S@@](=O)CCCCNC(=S)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CS(=O)CCCCNC(=S)Nc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 8 |
| MolWt: | 444.54 | Num_heavy_atoms: | 29 |
| TPSA: | 154.65 | NumAromaticRings: | 2 |
Unique Aglycone
AD38800
Formula: C11H15ON6S2
Smiles:
CS(=O)CCCCNC(=S)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 311.42 | Num_heavy_atoms: | 20 |
| TPSA: | 93.37 | NumAromaticRings: | 1 |
