Glycoside
GD147014
Name:
2-(hydroxymethyl)-6-{[5-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxol-4-yl]oxy}oxane-3,4,5-triolFormula:
C17H22O9Smiles:
C=CCc1cc2c(c(OC3OC(CO)C(O)C(O)C3O)c1OC)OCO2Aglycone:
C=CCc1cc2c(c(O)c1OC)OCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 6 |
| MolWt: | 370.35 | Num_heavy_atoms: | 26 |
| TPSA: | 127.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD58893
Formula: C11H12O4
Smiles:
C=CCc1cc2c(c(O)c1OC)OCO2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 208.21 | Num_heavy_atoms: | 15 |
| TPSA: | 47.92 | NumAromaticRings: | 1 |
