Glycoside
GD070759
Name:
NoneFormula:
C18H27O5NSSmiles:
CC(C)(C)/C=C/Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
CC(C)(C)C=CNc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 369.48 | Num_heavy_atoms: | 25 |
| TPSA: | 102.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD33486
Formula: C12H17NS
Smiles:
CC(C)(C)C=CNc1ccc(S)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 3.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 207.34 | Num_heavy_atoms: | 14 |
| TPSA: | 12.03 | NumAromaticRings: | 1 |
