Glycoside
GD135047
Name:
9-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4-methoxy-7H-furo[3,2-g]chromen-7-oneFormula:
C23H26O14Smiles:
COc1c2ccoc2c(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)c2oc(=O)ccc12Aglycone:
COc1c2ccoc2c(O)c2oc(=O)ccc12Sugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 7 |
| MolWt: | 526.45 | Num_heavy_atoms: | 37 |
| TPSA: | 210.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD46587
Formula: C12H8O5
Smiles:
COc1c2ccoc2c(O)c2oc(=O)ccc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 232.19 | Num_heavy_atoms: | 17 |
| TPSA: | 72.81 | NumAromaticRings: | 3 |
