Glycoside
GD069689
Name:
NoneFormula:
C14H22O4N5SSmiles:
C[NH+](C)CCSc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C[NH+](C)CCSc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -2.33 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.43 | Num_heavy_atoms: | 24 |
| TPSA: | 117.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD33037
Formula: C9H13N5S
Smiles:
C[NH+](C)CCSc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 223.31 | Num_heavy_atoms: | 15 |
| TPSA: | 56.68 | NumAromaticRings: | 1 |
