Glycoside
GD121861
Name:
3-(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl)-1,3-dihydro-2-benzofuran-1-oneFormula:
C17H22O8Smiles:
O=C1OC(CCCOC2OC(CO)C(O)C(O)C2O)c2ccccc21Aglycone:
O=C1OC(CCCO)c2ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 354.36 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD46012
Formula: C11H12O3
Smiles:
O=C1OC(CCCO)c2ccccc21| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.21 | Num_heavy_atoms: | 14 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
