Glycoside
GD103240
Name:
NoneFormula:
C20H24O5N6S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(S(=O)(=O)NC5CC5)cc4)ncnc32)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(NC1CC1)c1ccc(Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 8 |
| MolWt: | 492.58 | Num_heavy_atoms: | 33 |
| TPSA: | 151.49 | NumAromaticRings: | 3 |
Unique Aglycone
AD43682
Formula: C14H13O2N6S
Smiles:
O=S(=O)(NC1CC1)c1ccc(Nc2ncnc3c2N=C[N]3)cc1| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 329.37 | Num_heavy_atoms: | 23 |
| TPSA: | 110.44 | NumAromaticRings: | 2 |
