Glycoside
GD157650
Name:
7-[(3,4-dihydroxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-4H-chromen-4-oneFormula:
C30H36O16Smiles:
COc1cc(-c2cc(=O)c3c(OC)cc(OC4OC(C)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4O)cc3o2)cc(OC)c1OAglycone:
COc1cc(-c2cc(=O)c3c(OC)cc(O)cc3o2)cc(OC)c1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 9 |
| MolWt: | 652.6 | Num_heavy_atoms: | 46 |
| TPSA: | 236.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD62311
Formula: C18H16O7
Smiles:
COc1cc(-c2cc(=O)c3c(OC)cc(O)cc3o2)cc(OC)c1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.32 | Num_heavy_atoms: | 25 |
| TPSA: | 98.36 | NumAromaticRings: | 3 |
