Glycoside
GD122521
Name:
2-[(4-hydroxy-2,6-dimethoxycyclohexa-2,4-dien-1-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C14H22O9Smiles:
COC1=CC(O)=CC(OC)C1OC1OC(CO)C(O)C(O)C1OAglycone:
COC1=CC(O)=CC(OC)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 334.32 | Num_heavy_atoms: | 23 |
| TPSA: | 138.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD49381
Formula: C8H12O4
Smiles:
COC1=CC(O)=CC(OC)C1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 172.18 | Num_heavy_atoms: | 12 |
| TPSA: | 58.92 | NumAromaticRings: | 0 |
