Glycoside
GD145592
Name:
7-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-8-hydroxy-6-methoxy-2H-chromen-2-oneFormula:
C21H26O14Smiles:
COc1cc2ccc(=O)oc2c(O)c1OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1OAglycone:
COc1cc2ccc(=O)oc2c(O)c1OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.57 |
| AlogP: | -2.85 | Num_rotatable_bonds: | 7 |
| MolWt: | 502.43 | Num_heavy_atoms: | 35 |
| TPSA: | 217.97 | NumAromaticRings: | 2 |
Unique Aglycone
AD09781
Formula: C10H8O5
Smiles:
COc1cc2ccc(=O)oc2c(O)c1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 208.17 | Num_heavy_atoms: | 15 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
