Glycoside
GD148524
Name:
3,7,10-trimethyl-11-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-15-oxapentacyclo[7.5.1.0²,â¶.0â·,¹³.0¹â°,¹â´]pentadecane-3,6,9,14-tetrolFormula:
C26H42O11Smiles:
CC(COC1OC(CO)C(O)C(O)C1O)C1CC2C3(C)CC4(O)OC(C5C(C)(O)CCC53O)C2(O)C14CAglycone:
CC(CO)C1CC2C3(C)CC4(O)OC(C5C(C)(O)CCC53O)C2(O)C14CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 530.61 | Num_heavy_atoms: | 37 |
| TPSA: | 189.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD59434
Formula: C20H32O6
Smiles:
CC(CO)C1CC2C3(C)CC4(O)OC(C5C(C)(O)CCC53O)C2(O)C14C| HBA: | 6 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 2 |
| MolWt: | 368.47 | Num_heavy_atoms: | 26 |
| TPSA: | 110.38 | NumAromaticRings: | 0 |
