Glycoside
GD099532
Name:
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-oneFormula:
C24H24O10Smiles:
Cc1oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2Aglycone:
Cc1oc2cc(O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 472.45 | Num_heavy_atoms: | 34 |
| TPSA: | 148.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD42292
Formula: C18H14O5
Smiles:
Cc1oc2cc(O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 3.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 310.31 | Num_heavy_atoms: | 23 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
