Glycoside
GD155641
Name:
4-(acetyloxy)-2,5-dihydroxy-6-[2-(methylamino)ethyl]oxan-3-yl 2-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-[3-(2-hydroxyethyl)phenyl]butanoateFormula:
C30H39O10NSmiles:
CNCCC1OC(O)C(OC(=O)C(=Cc2ccc(O)c(OC)c2)CCc2cccc(CCO)c2)C(OC(C)=O)C1OAglycone:
COc1cc(C=C(CCc2cccc(CCO)c2)C(=O)O)ccc1OSugarmoiety:
CNCCC1OC(O)C(O)C(OC(C)=O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 13 |
| MolWt: | 573.64 | Num_heavy_atoms: | 41 |
| TPSA: | 164.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD46878
Formula: C20H22O5
Smiles:
COc1cc(C=C(CCc2cccc(CCO)c2)C(=O)O)ccc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 342.39 | Num_heavy_atoms: | 25 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
