Glycoside
GD082349
Name:
NoneFormula:
C16H24O8N2SSmiles:
CC(C)(C)C(=O)OCc1nc(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cs1Aglycone:
CC(C)(C)C(=O)OCc1nc(C(N)=O)cs1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.44 | Num_heavy_atoms: | 27 |
| TPSA: | 158.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD36992
Formula: C10H14O3N2S
Smiles:
CC(C)(C)C(=O)OCc1nc(C(N)=O)cs1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 242.3 | Num_heavy_atoms: | 16 |
| TPSA: | 82.28 | NumAromaticRings: | 1 |
