Glycoside
GD124809
Name:
NoneFormula:
C24H40O23SSmiles:
O=S(=O)(O)OCC1OC(OC2C(O)C(CO)OC(OC3C4COC3C(O)C(OC3C(O)C(O)OC(CO)C3O)O4)C2O)C(O)C(O)C1OAglycone:
COS(=O)(=O)O.OC1OC2COC(C1O)C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(OC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 23 | RingCount: | 5 |
| HBD: | 12 | FractionCSP3: | 1.0 |
| AlogP: | -8.88 | Num_rotatable_bonds: | 11 |
| MolWt: | 728.63 | Num_heavy_atoms: | 48 |
| TPSA: | 359.97 | NumAromaticRings: | 0 |
Unique Aglycone
AD00053
Formula: CH4O4S
Smiles:
COS(=O)(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.11 | Num_heavy_atoms: | 6 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
AD02564
Formula: C6H10O5
Smiles:
OC1OC2COC(C1O)C2O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -2.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.14 | Num_heavy_atoms: | 11 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
