Glycoside
GD121057
Name:
2-{4-[(4,5-dihydroxy-2-methoxyoxan-3-yl)oxy]-3,5-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C20H30O13Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)cc(OC)c1OC1C(OC)OCC(O)C1OAglycone:
COc1cc(O)cc(OC)c1OSugarmoiety:
COC1OCC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.7 |
| AlogP: | -2.65 | Num_rotatable_bonds: | 8 |
| MolWt: | 478.45 | Num_heavy_atoms: | 33 |
| TPSA: | 185.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD02608
Formula: C8H10O4
Smiles:
COc1cc(O)cc(OC)c1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 170.16 | Num_heavy_atoms: | 12 |
| TPSA: | 58.92 | NumAromaticRings: | 1 |
