Glycoside
GD134532
Name:
2-(3,4-dihydroxyphenyl)-5-hydroxy-6,8-bis[(3,4,5-trihydroxyoxan-2-yl)oxy]-4H-chromen-4-oneFormula:
C25H26O15Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(OC3OCC(O)C(O)C3O)cc(OC3OCC(O)C(O)C3O)c(O)c12Aglycone:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)cc(O)c(O)c12Sugarmoiety:
OC1COC(O)C(O)C1O.OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.4 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 566.47 | Num_heavy_atoms: | 40 |
| TPSA: | 249.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD54421
Formula: C15H10O7
Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)cc(O)c(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.24 | Num_heavy_atoms: | 22 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
