Glycoside
GD033341
Name:
NoneFormula:
C17H23O7NS2Smiles:
CCOC(=O)c1c(NC(=O)SC[C@@H]2O[C@H](O)[C@H](O)[C@H]2O)sc2c1CCCC2Aglycone:
CCOC(=O)c1c(NC(=O)SC)sc2c1CCCC2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 5 |
| MolWt: | 417.51 | Num_heavy_atoms: | 27 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD21291
Formula: C13H17O3NS2
Smiles:
CCOC(=O)c1c(NC(=O)SC)sc2c1CCCC2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 299.42 | Num_heavy_atoms: | 19 |
| TPSA: | 55.4 | NumAromaticRings: | 1 |
