Glycoside

GD140147
Name:
[3-(acetyloxy)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methyl acetateFormula:
C13H16O8N2Smiles:
CC(=O)OCC1OC(n2ccc(O)nc2=O)C(O)C1OC(C)=OAglycone:
COC(C)=O.O=c1nc(O)cc[nH]1Sugarmoiety:
CC(=O)OC1C(O)OC(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.54 |
AlogP: | -1.3 | Num_rotatable_bonds: | 4 |
MolWt: | 328.28 | Num_heavy_atoms: | 23 |
TPSA: | 137.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=OHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
MolWt: | 74.08 | Num_heavy_atoms: | 5 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD15478
Formula: C4H4O2N2
Smiles:
O=c1nc(O)cc[nH]1HBA: | 4 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | -0.52 | Num_rotatable_bonds: | 0 |
MolWt: | 112.09 | Num_heavy_atoms: | 8 |
TPSA: | 65.98 | NumAromaticRings: | 1 |