Glycoside
GD017558
Name:
NoneFormula:
C15H19O7SSmiles:
CO[C@@H]1O[C@H](CSC(C(=O)[O-])c2ccccc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
CSC(C(=O)[O-])c1ccccc1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 343.38 | Num_heavy_atoms: | 23 |
| TPSA: | 119.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD12515
Formula: C9H9O2S
Smiles:
CSC(C(=O)[O-])c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.22 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 181.24 | Num_heavy_atoms: | 12 |
| TPSA: | 40.13 | NumAromaticRings: | 1 |
