Glycoside
GD091404
Name:
NoneFormula:
C15H20O5N6S2Smiles:
COC(=O)CNC(=S)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSC)[C@@H](O)[C@H]1OAglycone:
COC(=O)CNC(=S)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 6 |
| MolWt: | 428.5 | Num_heavy_atoms: | 28 |
| TPSA: | 143.65 | NumAromaticRings: | 2 |
Unique Aglycone
AD34718
Formula: C9H9O2N6S
Smiles:
COC(=O)CNC(=S)Nc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 265.28 | Num_heavy_atoms: | 18 |
| TPSA: | 102.6 | NumAromaticRings: | 1 |
