Glycoside
GD129275
Name:
4-({2,4-dihydroxy-6-[(2,3,4,5-tetrahydroxypentyl)amino]pyrimidin-5-yl}-C-hydroxycarbonimidoyl)butanoic acidFormula:
C14H22O9N4Smiles:
O=C(O)CCCC(O)=Nc1c(O)nc(O)nc1NCC(O)C(O)C(O)COAglycone:
CNc1nc(O)nc(O)c1N=C(O)CCCC(=O)OSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.57 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 11 |
| MolWt: | 390.35 | Num_heavy_atoms: | 27 |
| TPSA: | 229.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD52374
Formula: C10H14O5N4
Smiles:
CNc1nc(O)nc(O)c1N=C(O)CCCC(=O)O| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 6 |
| MolWt: | 270.24 | Num_heavy_atoms: | 19 |
| TPSA: | 148.16 | NumAromaticRings: | 1 |
