Glycoside
GD130068
Name:
2-ethyl-5,7-dihydroxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-oneFormula:
C17H20O10Smiles:
CCc1cc(=O)c2c(O)cc(O)c(OC3OC(CO)C(O)C(O)C3O)c2o1Aglycone:
CCc1cc(=O)c2c(O)cc(O)c(O)c2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 384.34 | Num_heavy_atoms: | 27 |
| TPSA: | 170.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD52694
Formula: C11H10O5
Smiles:
CCc1cc(=O)c2c(O)cc(O)c(O)c2o1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 222.2 | Num_heavy_atoms: | 16 |
| TPSA: | 90.9 | NumAromaticRings: | 2 |
