Glycoside
GD129715
Name:
2-(4-ethoxyphenyl)-7-methoxy-5-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-oneFormula:
C30H36O15Smiles:
CCOc1ccc(-c2cc(=O)c3c(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)cc(OC)cc3o2)cc1Aglycone:
CCOc1ccc(-c2cc(=O)c3c(O)cc(OC)cc3o2)cc1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 10 |
| MolWt: | 636.6 | Num_heavy_atoms: | 45 |
| TPSA: | 227.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD52550
Formula: C18H16O5
Smiles:
CCOc1ccc(-c2cc(=O)c3c(O)cc(OC)cc3o2)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 3.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.32 | Num_heavy_atoms: | 23 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
