Glycoside
GD119692
Name:
4-[(6-{[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]methyl}-3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-6-(1,2-dihydroxyethyl)-2,5-dihydroxyoxane-2-carboxylic acidFormula:
C26H42O24Smiles:
O=C(O)C1OC(OCC2OC(OC3CC(O)(C(=O)O)OC(C(O)CO)C3O)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
[empty]Sugarmoiety:
O=C(O)C1OC(OCC2OC(OC3CC(O)(C(=O)O)OC(C(O)CO)C3O)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 24 | RingCount: | 4 |
| HBD: | 15 | FractionCSP3: | 0.92 |
| AlogP: | -9.81 | Num_rotatable_bonds: | 12 |
| MolWt: | 738.6 | Num_heavy_atoms: | 50 |
| TPSA: | 402.2 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD05488
O=C(O)C1OC(OCC2OC(OC3CC(O)(C(=O)O)OC(C(O)CO)C3O)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O