Glycoside
GD139906
Name:
2-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidine-5-carboximidamideFormula:
C12H16O5N6Smiles:
N=C(N)c1cn(C2OC(CO)C(O)C2O)c2[nH]c(=N)nc(O)c12Aglycone:
N=C(N)C1=C[N]c2[nH]c(=N)nc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.42 |
| AlogP: | -2.55 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.3 | Num_heavy_atoms: | 23 |
| TPSA: | 197.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD56423
Formula: C7H7ON6
Smiles:
N=C(N)C1=C[N]c2[nH]c(=N)nc(O)c21| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.0 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 1 |
| MolWt: | 191.17 | Num_heavy_atoms: | 14 |
| TPSA: | 136.73 | NumAromaticRings: | 1 |
