Glycoside
GD095723
Name:
NoneFormula:
C13H14O6N5SISmiles:
N#CCS(=O)(=O)Nc1ncnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
N#CCS(=O)(=O)Nc1ncnc2c1C(I)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 495.26 | Num_heavy_atoms: | 26 |
| TPSA: | 170.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD40805
Formula: C8H5O2N5SI
Smiles:
N#CCS(=O)(=O)Nc1ncnc2c1C(I)=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.13 | Num_heavy_atoms: | 17 |
| TPSA: | 109.84 | NumAromaticRings: | 1 |
