Glycoside
GD057252
Name:
NoneFormula:
C12H16O5N4SSmiles:
Cc1csc(-c2cn(C[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)nn2)n1Aglycone:
Cc1csc(-c2cn(C)nn2)n1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -1.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 328.35 | Num_heavy_atoms: | 22 |
| TPSA: | 133.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD28719
Formula: C7H8N4S
Smiles:
Cc1csc(-c2cn(C)nn2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.24 | Num_heavy_atoms: | 12 |
| TPSA: | 43.6 | NumAromaticRings: | 2 |
