Glycoside
GD088402
Name:
NoneFormula:
C18H30O8N2SSmiles:
CC(C)(C)OC(=O)N1CC2(C1)SCC[C@@H]2C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CC2(C1)SCCC2C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 434.51 | Num_heavy_atoms: | 29 |
| TPSA: | 148.79 | NumAromaticRings: | 0 |
Unique Aglycone
AD38669
Formula: C12H20O3N2S
Smiles:
CC(C)(C)OC(=O)N1CC2(C1)SCCC2C(N)=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.83 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 272.37 | Num_heavy_atoms: | 18 |
| TPSA: | 72.63 | NumAromaticRings: | 0 |
