Glycoside
GD019964
Name:
NoneFormula:
C20H32O7SSmiles:
CC(C)(C)c1cc(C(C)(C)C)c(SC2OC(CO)C(O)C(O)C2O)c(O)c1OAglycone:
CC(C)(C)c1cc(C(C)(C)C)c(S)c(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.7 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 416.54 | Num_heavy_atoms: | 28 |
| TPSA: | 130.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD13856
Formula: C14H22O2S
Smiles:
CC(C)(C)c1cc(C(C)(C)C)c(S)c(O)c1O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 3.98 | Num_rotatable_bonds: | 0 |
| MolWt: | 254.39 | Num_heavy_atoms: | 17 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
