Glycoside
GD127944
Name:
(2-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2,6-dimethoxybenzoateFormula:
C22H26O11Smiles:
COc1cccc(OC)c1C(=O)OCc1c(O)cccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cccc(OC)c1C(=O)OCc1c(O)cccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 8 |
| MolWt: | 466.44 | Num_heavy_atoms: | 33 |
| TPSA: | 164.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD51828
Formula: C16H16O6
Smiles:
COc1cccc(OC)c1C(=O)OCc1c(O)cccc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 304.3 | Num_heavy_atoms: | 22 |
| TPSA: | 85.22 | NumAromaticRings: | 2 |
