Glycoside
GD005337
Name:
NoneFormula:
C14H22O6N2SSmiles:
CC(C)(C)C(=O)c1cnc(N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1Aglycone:
CC(C)(C)C(=O)c1cnc(N)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.41 | Num_heavy_atoms: | 23 |
| TPSA: | 132.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD04550
Formula: C8H12ON2S
Smiles:
CC(C)(C)C(=O)c1cnc(N)s1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 184.26 | Num_heavy_atoms: | 12 |
| TPSA: | 55.98 | NumAromaticRings: | 1 |
