Glycoside

GD132534
Name:
[3,4-bis(acetyloxy)-5-[(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)methyl]oxolan-2-yl]methyl acetateFormula:
C16H20O9N2Smiles:
CC(=O)OCC1OC(Cn2ccc(O)nc2=O)C(OC(C)=O)C1OC(C)=OAglycone:
COC(C)=O.Cn1ccc(O)nc1=OSugarmoiety:
CC(=O)OC1C(O)OC(O)C1OC(C)=OOther Identifiers
Properties
HBA: | 11 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.56 |
AlogP: | -0.86 | Num_rotatable_bonds: | 6 |
MolWt: | 384.34 | Num_heavy_atoms: | 27 |
TPSA: | 143.25 | 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 |
AD45166
Formula: C5H6O2N2
Smiles:
Cn1ccc(O)nc1=OHBA: | 4 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.2 |
AlogP: | -0.51 | Num_rotatable_bonds: | 0 |
MolWt: | 126.11 | Num_heavy_atoms: | 9 |
TPSA: | 55.12 | NumAromaticRings: | 1 |