Glycoside
GD156866
Name:
5-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}-2,3,4,5-tetrahydroxypentanalFormula:
C20H18O11Smiles:
O=CC(O)C(O)C(O)C(O)Oc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=OAglycone:
O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12Sugarmoiety:
O=CC(O)C(O)C(O)C(O)OOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.2 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 7 |
| MolWt: | 434.35 | Num_heavy_atoms: | 31 |
| TPSA: | 198.12 | 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 |
