Glycoside
GD056154
Name:
NoneFormula:
C12H17O6N3SSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1nnsc1C1CC1Aglycone:
NC(=O)c1nnsc1C1CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | -2.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.35 | Num_heavy_atoms: | 22 |
| TPSA: | 145.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD28232
Formula: C6H7ON3S
Smiles:
NC(=O)c1nnsc1C1CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 169.21 | Num_heavy_atoms: | 11 |
| TPSA: | 68.87 | NumAromaticRings: | 1 |
