Glycoside
GD018327
Name:
NoneFormula:
C12H15O3N5SSmiles:
C[C@@H]1OC(n2cc(C(=N)S)c3c(N)ncnc32)[C@H](O)[C@H]1OAglycone:
N=C(S)C1=C[N]c2ncnc(N)c21Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 2 |
| MolWt: | 309.35 | Num_heavy_atoms: | 21 |
| TPSA: | 130.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD12949
Formula: C7H6N5S
Smiles:
N=C(S)C1=C[N]c2ncnc(N)c21| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 1 |
| MolWt: | 192.23 | Num_heavy_atoms: | 13 |
| TPSA: | 89.75 | NumAromaticRings: | 1 |
