Glycoside
GD098022
Name:
NoneFormula:
C17H21O6N6ClSSmiles:
CCOC(=O)CCNC(=S)Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOC(=O)CCNC(=S)Nc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 7 |
| MolWt: | 460.9 | Num_heavy_atoms: | 30 |
| TPSA: | 163.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD41706
Formula: C12H12O2N6ClS
Smiles:
CCOC(=O)CCNC(=S)Nc1nc(Cl)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 327.78 | Num_heavy_atoms: | 21 |
| TPSA: | 102.6 | NumAromaticRings: | 1 |
