Glycoside
GD128464
Name:
8-(2,3,4,5-tetrahydroxypentyl)-1,2,3,4,7,8-hexahydropteridine-2,4,7-trioneFormula:
C11H14O7N4Smiles:
O=c1cnc2c(O)nc(O)nc2n1CC(O)C(O)C(O)COAglycone:
Cn1c(=O)cnc2c(O)nc(O)nc21Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -3.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 314.25 | Num_heavy_atoms: | 22 |
| TPSA: | 182.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD52032
Formula: C7H6O3N4
Smiles:
Cn1c(=O)cnc2c(O)nc(O)nc21| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 194.15 | Num_heavy_atoms: | 14 |
| TPSA: | 101.13 | NumAromaticRings: | 2 |
