Glycoside
GD102333
Name:
NoneFormula:
C24H24O7N2SSmiles:
O=C(Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1)c1ccc(=O)n(-c2ccccc2)c1Aglycone:
O=C(Nc1ccc(S)cc1)c1ccc(=O)n(-c2ccccc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 484.53 | Num_heavy_atoms: | 34 |
| TPSA: | 141.25 | NumAromaticRings: | 3 |
Unique Aglycone
AD43309
Formula: C18H14O2N2S
Smiles:
O=C(Nc1ccc(S)cc1)c1ccc(=O)n(-c2ccccc2)c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.38 | Num_rotatable_bonds: | 3 |
| MolWt: | 322.39 | Num_heavy_atoms: | 23 |
| TPSA: | 51.1 | NumAromaticRings: | 3 |
