Glycoside
GD088743
Name:
NoneFormula:
C16H22O6N6SSmiles:
CCOC(=O)CCNC(=S)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCOC(=O)CCNC(=S)Nc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 7 |
| MolWt: | 426.46 | Num_heavy_atoms: | 29 |
| TPSA: | 163.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD38827
Formula: C11H13O2N6S
Smiles:
CCOC(=O)CCNC(=S)Nc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 293.33 | Num_heavy_atoms: | 20 |
| TPSA: | 102.6 | NumAromaticRings: | 1 |
