Glycoside
GD155085
Name:
5,2'-Dihydroxy-7,8,6'-Trimethoxyflavanone 2'-O-GlucuronideFormula:
C24H26O13Smiles:
COc1cc(O)c2c(c1OC)OC(c1c(OC)cccc1OC1OC(C(=O)O)C(O)C(O)C1O)CC2=OAglycone:
COc1cc(O)c2c(c1OC)OC(c1c(O)cccc1OC)CC2=OSugarmoiety:
CO.O=C(O)C1OOC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 522.46 | Num_heavy_atoms: | 37 |
| TPSA: | 190.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD46669
Formula: C18H18O7
Smiles:
COc1cc(O)c2c(c1OC)OC(c1c(O)cccc1OC)CC2=O| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.28 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.34 | Num_heavy_atoms: | 25 |
| TPSA: | 94.45 | NumAromaticRings: | 2 |
