Glycoside

GD121227
Name:
[({2-[1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)ethoxy]-3-hydroxybutoxy}(hydroxy)phosphoryl)oxy][3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phosphinic acidFormula:
C16H28O15N2P2Smiles:
CC(O)C(COP(=O)(O)OP(=O)(O)C1OC(CO)C(O)C(O)C1O)OC(C)n1ccc(O)nc1=OAglycone:
CC(O)C(COP(=O)(O)O[PH](=O)O)OC(C)n1ccc(O)nc1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 17 | RingCount: | 2 |
HBD: | 8 | FractionCSP3: | 0.75 |
AlogP: | -2.65 | Num_rotatable_bonds: | 11 |
MolWt: | 550.35 | Num_heavy_atoms: | 35 |
TPSA: | 267.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD48778
Formula: C10H18O10N2P2
Smiles:
CC(O)C(COP(=O)(O)O[PH](=O)O)OC(C)n1ccc(O)nc1=OHBA: | 12 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.6 |
AlogP: | -0.25 | Num_rotatable_bonds: | 9 |
MolWt: | 388.21 | Num_heavy_atoms: | 24 |
TPSA: | 177.64 | NumAromaticRings: | 1 |