Glycoside
GD121177
Name:
2-{1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl}acetamideFormula:
C11H15O6N3SSmiles:
N=C(O)Cc1cn(C2OC(CO)C(O)C2O)c(=S)nc1OAglycone:
N=C(O)Cc1c[nH]c(=S)nc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 317.32 | Num_heavy_atoms: | 21 |
| TPSA: | 152.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD48750
Formula: C6H7O2N3S
Smiles:
N=C(O)Cc1c[nH]c(=S)nc1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.17 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 185.21 | Num_heavy_atoms: | 12 |
| TPSA: | 92.99 | NumAromaticRings: | 1 |
