Glycoside
GD141426
Name:
5-{5,7-dihydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl}pentane-1,2,3,4-tetrolFormula:
C9H13O6N5Smiles:
OCC(O)C(O)C(O)Cn1nnc2c(O)nc(O)nc21Aglycone:
Cn1nnc2c(O)nc(O)nc21Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -3.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 287.23 | Num_heavy_atoms: | 20 |
| TPSA: | 177.87 | NumAromaticRings: | 2 |
Unique Aglycone
AD56977
Formula: C5H5O2N5
Smiles:
Cn1nnc2c(O)nc(O)nc21| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 0 |
| MolWt: | 167.13 | Num_heavy_atoms: | 12 |
| TPSA: | 96.95 | NumAromaticRings: | 2 |
