Glycoside
GD152566
Name:
6,7'-dihydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,2'H-[8,8'-bichromene]-2,2'-dioneFormula:
C24H20O12Smiles:
O=c1ccc2ccc(O)c(-c3c(OC4OC(CO)C(O)C(O)C4O)c(O)cc4ccc(=O)oc34)c2o1Aglycone:
O=c1ccc2ccc(O)c(-c3c(O)c(O)cc4ccc(=O)oc34)c2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.25 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 500.41 | Num_heavy_atoms: | 36 |
| TPSA: | 200.26 | NumAromaticRings: | 4 |
Unique Aglycone
AD52001
Formula: C18H10O7
Smiles:
O=c1ccc2ccc(O)c(-c3c(O)c(O)cc4ccc(=O)oc34)c2o1| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 338.27 | Num_heavy_atoms: | 25 |
| TPSA: | 121.11 | NumAromaticRings: | 4 |
