Glycoside
GD151079
Name:
2-(hydroxymethyl)-6-{[2-(4-hydroxyphenyl)-4-methoxy-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-3,4,5-triolFormula:
C22H26O9Smiles:
COC1CC(c2ccc(O)cc2)Oc2cc(OC3OC(CO)C(O)C(O)C3O)ccc21Aglycone:
COC1CC(c2ccc(O)cc2)Oc2cc(O)ccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 434.44 | Num_heavy_atoms: | 31 |
| TPSA: | 138.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD48802
Formula: C16H16O4
Smiles:
COC1CC(c2ccc(O)cc2)Oc2cc(O)ccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 3.31 | Num_rotatable_bonds: | 2 |
| MolWt: | 272.3 | Num_heavy_atoms: | 20 |
| TPSA: | 58.92 | NumAromaticRings: | 2 |
