Glycoside
GD126225
Name:
1,8-dihydroxy-5,6-dimethoxy-2-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-9H-xanthen-9-oneFormula:
C26H30O16Smiles:
COc1cc(O)c2c(=O)c3c(O)c(OC4OC(COC5OCC(O)C(O)C5O)C(O)C(O)C4O)ccc3oc2c1OCAglycone:
COc1cc(O)c2c(=O)c3c(O)c(O)ccc3oc2c1OCSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 7 |
| MolWt: | 598.51 | Num_heavy_atoms: | 42 |
| TPSA: | 247.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD01881
Formula: C15H12O7
Smiles:
COc1cc(O)c2c(=O)c3c(O)c(O)ccc3oc2c1OC| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 2.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 304.25 | Num_heavy_atoms: | 22 |
| TPSA: | 109.36 | NumAromaticRings: | 3 |
