Glycoside
GD154431
Name:
3,4,5-trihydroxy-6-{[5-(hydroxymethyl)-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acidFormula:
C23H22O11Smiles:
COc1ccc(-c2coc3cc(OC4OC(C(=O)O)C(O)C(O)C4O)cc(CO)c3c2=O)cc1Aglycone:
COc1ccc(-c2coc3cc(O)cc(CO)c3c2=O)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 6 |
| MolWt: | 474.42 | Num_heavy_atoms: | 34 |
| TPSA: | 176.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD61341
Formula: C17H14O5
Smiles:
COc1ccc(-c2coc3cc(O)cc(CO)c3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 79.9 | NumAromaticRings: | 3 |
