Glycoside
GD120054
Name:
6,8-dimethoxy-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C23H30O15Smiles:
COc1cc2ccc(=O)oc2c(OC)c1OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
COc1cc2ccc(=O)oc2c(OC)c1OSugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.61 |
| AlogP: | -3.19 | Num_rotatable_bonds: | 8 |
| MolWt: | 546.48 | Num_heavy_atoms: | 38 |
| TPSA: | 227.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD09776
Formula: C11H10O5
Smiles:
COc1cc2ccc(=O)oc2c(OC)c1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 222.2 | Num_heavy_atoms: | 16 |
| TPSA: | 68.9 | NumAromaticRings: | 2 |
