Glycoside
GD080463
Name:
NoneFormula:
C16H23O9NSSmiles:
Cc1ccc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C(=O)OAglycone:
Cc1ccc(S(=O)(=O)NCCO)cc1C(=O)OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 405.43 | Num_heavy_atoms: | 27 |
| TPSA: | 162.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD36437
Formula: C10H13O5NS
Smiles:
Cc1ccc(S(=O)(=O)NCCO)cc1C(=O)O| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 259.28 | Num_heavy_atoms: | 17 |
| TPSA: | 103.7 | NumAromaticRings: | 1 |
