Glycoside
GD105569
Name:
NoneFormula:
C28H34O4S2Smiles:
CCSC(SCC)[C@H](O)[C@H](O)[C@H](O)COC(c1ccccc1)(c1ccccc1)c1ccccc1Aglycone:
CCSCSCC.c1ccc(C(c2ccccc2)c2ccccc2)cc1Sugarmoiety:
OOCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 4.91 | Num_rotatable_bonds: | 13 |
| MolWt: | 498.71 | Num_heavy_atoms: | 34 |
| TPSA: | 69.92 | NumAromaticRings: | 3 |
Unique Aglycone
AD00424
Formula: C19H16
Smiles:
c1ccc(C(c2ccccc2)c2ccccc2)cc1| HBA: | 0 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.05 |
| AlogP: | 4.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.34 | Num_heavy_atoms: | 19 |
| TPSA: | 0.0 | NumAromaticRings: | 3 |
AD17625
Formula: C5H12S2
Smiles:
CCSCSCC| HBA: | 0 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 136.29 | Num_heavy_atoms: | 7 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |