Glycoside
GD090891
Name:
NoneFormula:
C19H27O8NSSmiles:
COC1(OC)CC(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)C1Aglycone:
COC1(OC)CC(C(=O)Nc2ccc(S)cc2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 429.49 | Num_heavy_atoms: | 29 |
| TPSA: | 137.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD39573
Formula: C13H17O3NS
Smiles:
COC1(OC)CC(C(=O)Nc2ccc(S)cc2)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.46 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 267.35 | Num_heavy_atoms: | 18 |
| TPSA: | 47.56 | NumAromaticRings: | 1 |
