Glycoside
GD153761
Name:
3-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-6-({2-carboxy-5,6-dihydroxy-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-3-yl}oxy)-4,5-dihydroxyoxane-2-carboxylic acidFormula:
C23H34O23Smiles:
O=C(O)C1OC(OC2C(C(=O)O)OC(OC3C(C(=O)O)OC(O)C(O)C3OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OAglycone:
[empty]Sugarmoiety:
O=C(O)C1OC(OC2C(C(=O)O)OC(OC3C(C(=O)O)OC(O)C(O)C3OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 23 | RingCount: | 4 |
| HBD: | 13 | FractionCSP3: | 0.87 |
| AlogP: | -8.83 | Num_rotatable_bonds: | 9 |
| MolWt: | 678.5 | Num_heavy_atoms: | 46 |
| TPSA: | 378.81 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD10159
O=C(O)C1OC(OC2C(C(=O)O)OC(OC3C(C(=O)O)OC(O)C(O)C3OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O