Glycoside
GD150857
Name:
2-[2-(3,5-dihydroxybenzoyl)-3-hydroxy-5-methoxyphenoxy]-6-methyloxane-3,4,5-triolFormula:
C20H22O10Smiles:
COc1cc(O)c(C(=O)c2cc(O)cc(O)c2)c(OC2OC(C)C(O)C(O)C2O)c1Aglycone:
COc1cc(O)c(C(=O)c2cc(O)cc(O)c2)c(O)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 422.39 | Num_heavy_atoms: | 30 |
| TPSA: | 166.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD47582
Formula: C14H12O6
Smiles:
COc1cc(O)c(C(=O)c2cc(O)cc(O)c2)c(O)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 276.24 | Num_heavy_atoms: | 20 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
