Glycoside
GD097338
Name:
NoneFormula:
C17H25O7N5S2Smiles:
COC(=O)CCCCS(=O)(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSC)[C@@H](O)[C@H]1OAglycone:
COC(=O)CCCCS(=O)(=O)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.65 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 10 |
| MolWt: | 475.55 | Num_heavy_atoms: | 31 |
| TPSA: | 165.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD41380
Formula: C11H14O4N5S
Smiles:
COC(=O)CCCCS(=O)(=O)Nc1ncnc2c1N=C[N]2| HBA: | 9 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 312.33 | Num_heavy_atoms: | 21 |
| TPSA: | 124.71 | NumAromaticRings: | 1 |
