Glycoside
GD119716
Name:
8-hydroxy-6-methoxy-3-methyl-7-(3-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-2-en-1-yl)-4H-chromen-4-oneFormula:
C22H28O10Smiles:
COc1cc2c(=O)c(C)coc2c(O)c1CC=C(C)COC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc2c(=O)c(C)coc2c(O)c1CC=C(C)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 452.46 | Num_heavy_atoms: | 32 |
| TPSA: | 159.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD48019
Formula: C16H18O5
Smiles:
COc1cc2c(=O)c(C)coc2c(O)c1CC=C(C)CO| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 290.32 | Num_heavy_atoms: | 21 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
