Glycoside
GD039110
Name:
1,6-di-o-phosphono-alpha-d-glucopyranoseFormula:
C6H13O12P2Smiles:
O=P(O)(O)OC[C@H]1O[C@H](O[P@](=O)([O-])O)[C@H](O)[C@H](O)[C@@H]1OAglycone:
COP(=O)(O)O.O=P([O-])(O)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -3.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 339.11 | Num_heavy_atoms: | 20 |
| TPSA: | 206.27 | NumAromaticRings: | 0 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD00190
Formula: H2O4P
Smiles:
O=P([O-])(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 96.99 | Num_heavy_atoms: | 5 |
| TPSA: | 80.59 | NumAromaticRings: | 0 |
