Glycoside
GD001783
Name:
NoneFormula:
C30H48O15S6Smiles:
Cc1c(CSS[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(C)c(CSS[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(C)c1CSS[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cc1c(CSS)c(C)c(CSS)c(C)c1CSSSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 12 | FractionCSP3: | 0.8 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 15 |
| MolWt: | 841.1 | Num_heavy_atoms: | 51 |
| TPSA: | 270.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD01750
Formula: C12H18S6
Smiles:
Cc1c(CSS)c(C)c(CSS)c(C)c1CSS| HBA: | 0 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 5.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 354.68 | Num_heavy_atoms: | 18 |
| TPSA: | 0.0 | NumAromaticRings: | 1 |
