Glycoside
GD007881
Name:
NoneFormula:
C11H12O3N3SISmiles:
C[C@@H]1O[C@H](n2cc(I)c3c(S)ncnc32)[C@H](O)[C@H]1OAglycone:
Sc1ncnc2c1C(I)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 1 |
| MolWt: | 393.21 | Num_heavy_atoms: | 19 |
| TPSA: | 80.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD06367
Formula: C6H3N3SI
Smiles:
Sc1ncnc2c1C(I)=C[N]2| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 0 |
| MolWt: | 276.08 | Num_heavy_atoms: | 11 |
| TPSA: | 39.88 | NumAromaticRings: | 1 |
