Glycoside
GD135841
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3,10-dimethyl-2-oxo-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-6-carboxylateFormula:
C21H30O9Smiles:
CC1=CC2OC(=O)C(C)C2CCC(C(=O)OC2OC(CO)C(O)C(O)C2O)=CCC1Aglycone:
CC1=CC2OC(=O)C(C)C2CCC(C(=O)O)=CCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 426.46 | Num_heavy_atoms: | 30 |
| TPSA: | 142.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD49924
Formula: C15H20O4
Smiles:
CC1=CC2OC(=O)C(C)C2CCC(C(=O)O)=CCC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 264.32 | Num_heavy_atoms: | 19 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
