Glycoside
GD022595
Name:
NoneFormula:
C24H32O10S4Smiles:
OC[C@@H]1O[C@H](SSCc2cccc3c(CSS[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cccc23)[C@H](O)[C@H](O)[C@H]1OAglycone:
SSCc1cccc2c(CSS)cccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.58 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 10 |
| MolWt: | 608.78 | Num_heavy_atoms: | 38 |
| TPSA: | 180.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD15299
Formula: C12H12S4
Smiles:
SSCc1cccc2c(CSS)cccc12| HBA: | 0 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.5 | Num_heavy_atoms: | 16 |
| TPSA: | 0.0 | NumAromaticRings: | 2 |
