Glycoside
GD129258
Name:
5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2,3,4,5,6-pentahydroxyhexyl)oxy]-4H-chromen-4-oneFormula:
C21H22O11Smiles:
O=c1cc(-c2ccc(O)cc2)oc2c(OCC(O)C(O)C(O)C(O)CO)c(O)cc(O)c12Aglycone:
O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.29 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 450.4 | Num_heavy_atoms: | 32 |
| TPSA: | 201.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD00529
Formula: C15H10O5
Smiles:
O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.24 | Num_heavy_atoms: | 20 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
