Glycoside
GD147456
Name:
5-(1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl)-3-({[3,4,5-tris(acetyloxy)oxan-2-yl]oxy}methyl)pent-2-en-1-yl acetateFormula:
C33H50O10Smiles:
CC(=O)OCC=C(CCC1(C)C(C)CCC2(C)C(C)=CCCC21)COC1OCC(OC(C)=O)C(OC(C)=O)C1OC(C)=OAglycone:
CC(=O)OCC=C(CO)CCC1(C)C(C)CCC2(C)C(C)=CCCC21Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.76 |
| AlogP: | 5.22 | Num_rotatable_bonds: | 11 |
| MolWt: | 606.75 | Num_heavy_atoms: | 43 |
| TPSA: | 123.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD59052
Formula: C22H36O3
Smiles:
CC(=O)OCC=C(CO)CCC1(C)C(C)CCC2(C)C(C)=CCCC21| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.77 |
| AlogP: | 5.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 348.53 | Num_heavy_atoms: | 25 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
