Glycoside
GD039692
Name:
(1s)-1,5-anhydro-4-o-alpha-d-glucopyranosyl-1-(phosphonomethyl)-d-glucitolFormula:
C13H25O13PSmiles:
O=P(O)(O)C[C@@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H]1OAglycone:
CP(=O)(O)OSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 1.0 |
| AlogP: | -5.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 420.3 | Num_heavy_atoms: | 27 |
| TPSA: | 226.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD00991
Formula: CH5O3P
Smiles:
CP(=O)(O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 96.02 | Num_heavy_atoms: | 5 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
