Glycoside
GD149219
Name:
methyl 3-(7-methoxy-4-oxo-4H-chromen-3-yl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzoateFormula:
C24H24O11Smiles:
COC(=O)c1cc(OC2OC(CO)C(O)C(O)C2O)cc(-c2coc3cc(OC)ccc3c2=O)c1Aglycone:
COC(=O)c1cc(O)cc(-c2coc3cc(OC)ccc3c2=O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 6 |
| MolWt: | 488.45 | Num_heavy_atoms: | 35 |
| TPSA: | 165.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD59675
Formula: C18H14O6
Smiles:
COC(=O)c1cc(O)cc(-c2coc3cc(OC)ccc3c2=O)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 326.3 | Num_heavy_atoms: | 24 |
| TPSA: | 85.97 | NumAromaticRings: | 3 |
