Glycoside
GD102951
Name:
NoneFormula:
C23H24O7N2SSmiles:
Cn1cc(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc2)c(=O)c2ccccc21Aglycone:
Cn1cc(C(=O)Nc2ccc(S)cc2)c(=O)c2ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 472.52 | Num_heavy_atoms: | 33 |
| TPSA: | 141.25 | NumAromaticRings: | 3 |
Unique Aglycone
AD43576
Formula: C17H14O2N2S
Smiles:
Cn1cc(C(=O)Nc2ccc(S)cc2)c(=O)c2ccccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 3.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 310.38 | Num_heavy_atoms: | 22 |
| TPSA: | 51.1 | NumAromaticRings: | 3 |
