Glycoside
GD150327
Name:
4,5-bis(acetyloxy)-6-{[7-methoxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-8-yl]oxy}-2-({[3,4,5-tris(acetyloxy)-6-methyloxan-2-yl]oxy}methyl)oxan-3-yl acetateFormula:
C41H46O20Smiles:
COc1ccc(-c2coc3c(OC4OC(COC5OC(C)C(OC(C)=O)C(OC(C)=O)C5OC(C)=O)C(OC(C)=O)C(OC(C)=O)C4OC(C)=O)c(OC)ccc3c2=O)cc1Aglycone:
COc1ccc(-c2coc3c(O)c(OC)ccc3c2=O)cc1Sugarmoiety:
CC(=O)OC1C(C)OC(OCC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.49 |
| AlogP: | 2.93 | Num_rotatable_bonds: | 14 |
| MolWt: | 858.8 | Num_heavy_atoms: | 61 |
| TPSA: | 243.39 | NumAromaticRings: | 3 |
Unique Aglycone
AD19281
Formula: C17H14O5
Smiles:
COc1ccc(-c2coc3c(O)c(OC)ccc3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 3.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
