Glycoside
GD150433
Name:
3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)-4H-chromen-4-oneFormula:
C22H22O10Smiles:
COc1cc(-c2oc3cc(C4OC(C)C(O)C(O)C4O)cc(O)c3c(=O)c2O)ccc1OAglycone:
COc1cc(-c2oc3cccc(O)c3c(=O)c2O)ccc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.32 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 446.41 | Num_heavy_atoms: | 32 |
| TPSA: | 170.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD60092
Formula: C16H12O6
Smiles:
COc1cc(-c2oc3cccc(O)c3c(=O)c2O)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.27 | Num_heavy_atoms: | 22 |
| TPSA: | 100.13 | NumAromaticRings: | 3 |
