Glycoside
GD035808
Name:
NoneFormula:
C26H21O10N3FClSSmiles:
N#Cc1cc(S(=O)(=O)Nc2ccc(F)cn2)ccc1Oc1ccc(CO[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)c(Cl)c1Aglycone:
N#Cc1cc(S(=O)(=O)Nc2ccc(F)cn2)ccc1Oc1ccc(CO)c(Cl)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.24 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 9 |
| MolWt: | 609.97 | Num_heavy_atoms: | 41 |
| TPSA: | 208.53 | NumAromaticRings: | 3 |
Unique Aglycone
AD22636
Formula: C20H13O4N3FClS
Smiles:
N#Cc1cc(S(=O)(=O)Nc2ccc(F)cn2)ccc1Oc1ccc(CO)c(Cl)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 3.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 433.85 | Num_heavy_atoms: | 29 |
| TPSA: | 112.31 | NumAromaticRings: | 3 |
