Glycoside
GD098073
Name:
NoneFormula:
C20H27O7N5SSmiles:
Cc1ccc(S(=O)(=O)N2CCCC2)cc1Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1ccc(S(=O)(=O)N2CCCC2)cc1NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 7 |
| MolWt: | 481.53 | Num_heavy_atoms: | 33 |
| TPSA: | 180.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD41728
Formula: C15H18O3N5S
Smiles:
Cc1ccc(S(=O)(=O)N2CCCC2)cc1NC1=C(C(N)=O)N=C[N]1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.41 | Num_heavy_atoms: | 24 |
| TPSA: | 118.96 | NumAromaticRings: | 1 |
