Glycoside
GD144617
Name:
2-{[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-5H-chromen-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H22O11Smiles:
OCC1OC(OC2=C(c3ccc(O)c(O)c3)OC3=CC(O)=CC(O)C3=C2)C(O)C(O)C1OAglycone:
OC1=CC(O)C2=CC(O)=C(c3ccc(O)c(O)c3)OC2=C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.33 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 450.4 | Num_heavy_atoms: | 32 |
| TPSA: | 189.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD58105
Formula: C15H12O6
Smiles:
OC1=CC(O)C2=CC(O)=C(c3ccc(O)c(O)c3)OC2=C1| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.07 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 288.26 | Num_heavy_atoms: | 21 |
| TPSA: | 110.38 | NumAromaticRings: | 1 |
