Glycoside
GD084061
Name:
NoneFormula:
C18H23O6N3SSmiles:
Cc1ccn(CC(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc2)n1Aglycone:
Cc1ccn(CC(=O)Nc2ccc(S)cc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 409.46 | Num_heavy_atoms: | 28 |
| TPSA: | 137.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD37518
Formula: C12H13ON3S
Smiles:
Cc1ccn(CC(=O)Nc2ccc(S)cc2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 247.32 | Num_heavy_atoms: | 17 |
| TPSA: | 46.92 | NumAromaticRings: | 2 |
