Glycoside
GD131998
Name:
2-({6-[(2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-4-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]-4-ethyl-3,5-dihydroxyoxan-2-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H46O20Smiles:
CCC1C(O)C(OC2OC(CO)C(O)C(O)C2O)OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC)C3O)C2O)C1OAglycone:
[empty]Sugarmoiety:
CCC1C(O)C(OC2OC(CO)C(O)C(O)C2O)OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC)C3O)C2O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 4 |
| HBD: | 12 | FractionCSP3: | 1.0 |
| AlogP: | -7.47 | Num_rotatable_bonds: | 11 |
| MolWt: | 678.63 | Num_heavy_atoms: | 46 |
| TPSA: | 316.6 | NumAromaticRings: | 0 |