Glycoside
GD136842
Name:
4-methoxy-6-(2-{3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}ethenyl)-2H-pyran-2-oneFormula:
C20H22O8Smiles:
COc1cc(C=Cc2cccc(OC3OC(C)C(O)C(O)C3O)c2)oc(=O)c1Aglycone:
COc1cc(C=Cc2cccc(O)c2)oc(=O)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 390.39 | Num_heavy_atoms: | 28 |
| TPSA: | 118.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD55312
Formula: C14H12O4
Smiles:
COc1cc(C=Cc2cccc(O)c2)oc(=O)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.25 | Num_heavy_atoms: | 18 |
| TPSA: | 59.67 | NumAromaticRings: | 2 |
