Glycoside
GD077673
Name:
NoneFormula:
C19H23O6NSSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cccc(-c3ccsc3)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cccc(-c2ccsc2)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 6 |
| MolWt: | 393.46 | Num_heavy_atoms: | 27 |
| TPSA: | 108.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD35554
Formula: C13H13O2NS
Smiles:
O=C(NCCO)c1cccc(-c2ccsc2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 247.32 | Num_heavy_atoms: | 17 |
| TPSA: | 49.33 | NumAromaticRings: | 2 |
