Glycoside
GD147818
Name:
2-{[4-hydroxy-2,5-bis(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxolan-2-yl]oxy}-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triolFormula:
C42H72O36Smiles:
OCC1OC(OCC2OC(OCC3OC(OCC4OC(OC5C(O)C(CO)OC5(CO)OC5OC(COC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5O)C(O)C(O)C4O)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
[empty]Sugarmoiety:
OCC1OC(OCC2OC(OCC3OC(OCC4OC(OC5C(O)C(CO)OC5(CO)OC5OC(COC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5O)C(O)C(O)C4O)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 36 | RingCount: | 7 |
| HBD: | 23 | FractionCSP3: | 1.0 |
| AlogP: | -16.27 | Num_rotatable_bonds: | 20 |
| MolWt: | 1153.0 | Num_heavy_atoms: | 78 |
| TPSA: | 585.28 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD09491
OCC1OC(OCC2OC(OCC3OC(OCC4OC(OC5C(O)C(CO)OC5(CO)OC5OC(COC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5O)C(O)C(O)C4O)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O