Glycoside
GD097370
Name:
NoneFormula:
C16H23O7N5S2Smiles:
COC(=O)CCCS(=O)(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSC)[C@@H](O)[C@H]1OAglycone:
COC(=O)CCCS(=O)(=O)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 9 |
| MolWt: | 461.52 | Num_heavy_atoms: | 30 |
| TPSA: | 165.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD41397
Formula: C10H12O4N5S
Smiles:
COC(=O)CCCS(=O)(=O)Nc1ncnc2c1N=C[N]2| HBA: | 9 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 298.3 | Num_heavy_atoms: | 20 |
| TPSA: | 124.71 | NumAromaticRings: | 1 |
