Glycoside
GD148918
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[6-(hydroxymethyl)-1-methyl-4-(propan-2-yl)-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]oxy}oxane-3,4,5-triolFormula:
C26H44O11Smiles:
CC(C)C1CCC(C)(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)C2CCC(CO)=CC12Aglycone:
CC(C)C1CCC(C)(O)C2CCC(CO)=CC12Sugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.92 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 8 |
| MolWt: | 532.63 | Num_heavy_atoms: | 37 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD59569
Formula: C15H26O2
Smiles:
CC(C)C1CCC(C)(O)C2CCC(CO)=CC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.87 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.37 | Num_heavy_atoms: | 17 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
