Glycoside
GD098748
Name:
NoneFormula:
C19H28O7N6SSmiles:
CCOC(=O)[C@@H](CCSC)NC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OCAglycone:
CCOC(=O)C(CCSC)NC(=O)Nc1ncnc2c1N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.63 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 10 |
| MolWt: | 484.54 | Num_heavy_atoms: | 33 |
| TPSA: | 169.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD42007
Formula: C13H17O3N6S
Smiles:
CCOC(=O)C(CCSC)NC(=O)Nc1ncnc2c1N=C[N]2| HBA: | 9 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 337.39 | Num_heavy_atoms: | 23 |
| TPSA: | 119.67 | NumAromaticRings: | 1 |
