Glycoside
GD121272
Name:
3,5-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-en-1-yl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C26H30O11Smiles:
CC(C)=CCc1c(OC2OC(CO)C(O)C(O)C2O)cc2c(c1O)C(=O)C(O)C(c1ccc(O)cc1)O2Aglycone:
CC(C)=CCc1c(O)cc2c(c1O)C(=O)C(O)C(c1ccc(O)cc1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.42 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 6 |
| MolWt: | 518.52 | Num_heavy_atoms: | 37 |
| TPSA: | 186.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD48803
Formula: C20H20O6
Smiles:
CC(C)=CCc1c(O)cc2c(c1O)C(=O)C(O)C(c1ccc(O)cc1)O2| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 356.37 | Num_heavy_atoms: | 26 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
