Glycoside
GD137730
Name:
7-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-3-(3,4-dimethoxyphenyl)-6-methoxy-4H-chromen-4-oneFormula:
C29H34O15Smiles:
COc1ccc(-c2coc3cc(OC4OC(COC5OCC(O)(CO)C5O)C(O)C(O)C4O)c(OC)cc3c2=O)cc1OCAglycone:
COc1cc2c(=O)c(-c3ccc(OC)c(OC)c3)coc2cc1OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.48 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 10 |
| MolWt: | 622.58 | Num_heavy_atoms: | 44 |
| TPSA: | 216.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD42304
Formula: C18H16O6
Smiles:
COc1cc2c(=O)c(-c3ccc(OC)c(OC)c3)coc2cc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.32 | Num_heavy_atoms: | 24 |
| TPSA: | 78.13 | NumAromaticRings: | 3 |
