Glycoside
GD147704
Name:
2-{[6,6-bis(3,4-dihydroxyphenyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C23H28O11Smiles:
OCC1OC(OC2CCC(c3ccc(O)c(O)c3)(c3ccc(O)c(O)c3)OC2)C(O)C(O)C1OAglycone:
Oc1ccc(C2(c3ccc(O)c(O)c3)CCC(O)CO2)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.48 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 480.47 | Num_heavy_atoms: | 34 |
| TPSA: | 189.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD59146
Formula: C17H18O6
Smiles:
Oc1ccc(C2(c3ccc(O)c(O)c3)CCC(O)CO2)cc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 318.33 | Num_heavy_atoms: | 23 |
| TPSA: | 110.38 | NumAromaticRings: | 2 |
