Glycoside
GD100839
Name:
NoneFormula:
C17H20O5N6S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(NS(=O)(=O)c4ccc(C)nc4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Cc1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)cn1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 452.52 | Num_heavy_atoms: | 30 |
| TPSA: | 152.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD42601
Formula: C11H9O2N6S
Smiles:
Cc1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)cn1| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.09 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 289.3 | Num_heavy_atoms: | 20 |
| TPSA: | 111.3 | NumAromaticRings: | 2 |
