Glycoside
GD132502
Name:
2-[5-(5,7-dihydroxy-4H-chromen-2-yl)-2-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H22O10Smiles:
OCC1OC(Oc2cc(C3=CCc4c(O)cc(O)cc4O3)ccc2O)C(O)C(O)C1OAglycone:
Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)=CC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 4 |
| MolWt: | 434.4 | Num_heavy_atoms: | 31 |
| TPSA: | 169.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD53654
Formula: C15H12O5
Smiles:
Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)=CC2| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 2.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
