Glycoside
GD134127
Name:
3-hydroxy-8-methoxy-3-methyl-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-1,2,3,4,7,12-hexahydrotetraphene-1,7,12-trioneFormula:
C26H26O10Smiles:
COc1cccc2c1C(=O)c1c(OC3OC(C)C(O)C(O)C3O)cc3c(c1C2=O)C(=O)CC(C)(O)C3Aglycone:
COc1cccc2c1C(=O)c1c(O)cc3c(c1C2=O)C(=O)CC(C)(O)C3Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 498.48 | Num_heavy_atoms: | 36 |
| TPSA: | 159.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD54264
Formula: C20H16O6
Smiles:
COc1cccc2c1C(=O)c1c(O)cc3c(c1C2=O)C(=O)CC(C)(O)C3| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 352.34 | Num_heavy_atoms: | 26 |
| TPSA: | 100.9 | NumAromaticRings: | 2 |
