Glycoside
GD103151
Name:
NoneFormula:
C20H20O6N5FSSmiles:
OC[C@H]1O[C@@H](n2cc(F)c3c(NC(=S)Nc4ccc5c(c4)OCCO5)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC1=C[N]c2ncnc(NC(=S)Nc3ccc4c(c3)OCCO4)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 477.47 | Num_heavy_atoms: | 33 |
| TPSA: | 143.15 | NumAromaticRings: | 3 |
Unique Aglycone
AD43638
Formula: C15H11O2N5FS
Smiles:
FC1=C[N]c2ncnc(NC(=S)Nc3ccc4c(c3)OCCO4)c21| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 344.35 | Num_heavy_atoms: | 24 |
| TPSA: | 82.4 | NumAromaticRings: | 2 |
