Glycoside
GD157794
Name:
2-{[2-(3,4-dihydroxyphenyl)-3-hydroxy-7-methoxy-3,4-dihydro-2H-1-benzopyran-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C22H26O11Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2Aglycone:
COc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.45 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 466.44 | Num_heavy_atoms: | 33 |
| TPSA: | 178.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD62349
Formula: C16H16O6
Smiles:
COc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 304.3 | Num_heavy_atoms: | 22 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
