Glycoside
GD129572
Name:
2-[4-(5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H24O9Smiles:
OCC1OC(Oc2ccc(C3CCc4c(O)cc(O)cc4O3)cc2)C(O)C(O)C1OAglycone:
Oc1ccc(C2CCc3c(O)cc(O)cc3O2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 420.41 | Num_heavy_atoms: | 30 |
| TPSA: | 149.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD50376
Formula: C15H14O4
Smiles:
Oc1ccc(C2CCc3c(O)cc(O)cc3O2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 2.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 258.27 | Num_heavy_atoms: | 19 |
| TPSA: | 69.92 | NumAromaticRings: | 2 |
