Glycoside
GD078898
Name:
NoneFormula:
C17H21O7NSSmiles:
CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](C)O[C@@H]1Sc1ccccn1Aglycone:
Sc1ccccn1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.53 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 5 |
| MolWt: | 383.42 | Num_heavy_atoms: | 26 |
| TPSA: | 101.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD19570
Formula: C5H5NS
Smiles:
Sc1ccccn1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.17 | Num_heavy_atoms: | 7 |
| TPSA: | 12.89 | NumAromaticRings: | 1 |
