Glycoside
GD038357
Name:
{[(2r,3r,4r,5r)-3-(alpha-d-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acidFormula:
C13H26O12NPSmiles:
O=P(O)(O)CN1[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]1COAglycone:
O=P(O)(O)CN1C(CO)C(O)C(O)C1COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 1.0 |
| AlogP: | -5.29 | Num_rotatable_bonds: | 7 |
| MolWt: | 419.32 | Num_heavy_atoms: | 27 |
| TPSA: | 220.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD23984
Formula: C7H16O7NP
Smiles:
O=P(O)(O)CN1C(CO)C(O)C(O)C1CO| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -3.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 257.18 | Num_heavy_atoms: | 16 |
| TPSA: | 141.69 | NumAromaticRings: | 0 |
