Glycoside
GD121110
Name:
6-{[2-({4,5-dihydroxy-6-[(4,5,6-trihydroxyoxan-3-yl)oxy]oxan-3-yl}oxy)-4,5-dihydroxyoxan-3-yl]oxy}-4,5-dihydroxy-3-methoxyoxane-2-carboxylic acidFormula:
C22H36O19Smiles:
COC1C(C(=O)O)OC(OC2C(OC3COC(OC4COC(O)C(O)C4O)C(O)C3O)OCC(O)C2O)C(O)C1OAglycone:
[empty]Sugarmoiety:
COC1C(C(=O)O)OC(OC2C(OC3COC(OC4COC(O)C(O)C4O)C(O)C3O)OCC(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.95 |
| AlogP: | -7.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 604.51 | Num_heavy_atoms: | 41 |
| TPSA: | 293.21 | NumAromaticRings: | 0 |