Glycoside
GD084438
Name:
NoneFormula:
C16H25O7NS2Smiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2cc3c(s2)CCCC3)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(NCCO)c1cc2c(s1)CCCC2Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 6 |
| MolWt: | 407.51 | Num_heavy_atoms: | 26 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD37708
Formula: C10H15O3NS2
Smiles:
O=S(=O)(NCCO)c1cc2c(s1)CCCC2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 261.37 | Num_heavy_atoms: | 16 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
