Glycoside
GD151865
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-3,9,14-triolFormula:
C26H42O10Smiles:
CC(COC1OC(CO)C(O)C(O)C1O)C1CC2C3(C)CC4(O)OC(C5C3CCC5(C)O)C2(O)C14CAglycone:
CC(CO)C1CC2C3(C)CC4(O)OC(C5C3CCC5(C)O)C2(O)C14CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 514.61 | Num_heavy_atoms: | 36 |
| TPSA: | 169.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD60522
Formula: C20H32O5
Smiles:
CC(CO)C1CC2C3(C)CC4(O)OC(C5C3CCC5(C)O)C2(O)C14C| HBA: | 5 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 352.47 | Num_heavy_atoms: | 25 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
