Glycoside
GD098229
Name:
NoneFormula:
C22H25O7N3SSmiles:
Cn1c(=O)n(CC(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)c2ccccc21Aglycone:
Cn1c(=O)n(CC(=O)Nc2ccc(S)cc2)c2ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 475.52 | Num_heavy_atoms: | 33 |
| TPSA: | 146.18 | NumAromaticRings: | 3 |
Unique Aglycone
AD41795
Formula: C16H15O2N3S
Smiles:
Cn1c(=O)n(CC(=O)Nc2ccc(S)cc2)c2ccccc21| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.38 | Num_heavy_atoms: | 22 |
| TPSA: | 56.03 | NumAromaticRings: | 3 |
