Glycoside
GD157897
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenoxy]oxane-3,4,5-triolFormula:
C21H30O12Smiles:
C=CCc1cc(OC)c(O)c(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)c1Aglycone:
C=CCc1cc(O)c(O)c(OC)c1Sugarmoiety:
CO.OCC1(O)COC(OCC2OOC(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | -2.23 | Num_rotatable_bonds: | 9 |
| MolWt: | 474.46 | Num_heavy_atoms: | 33 |
| TPSA: | 187.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD08364
Formula: C10H12O3
Smiles:
C=CCc1cc(O)c(O)c(OC)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 180.2 | Num_heavy_atoms: | 13 |
| TPSA: | 49.69 | NumAromaticRings: | 1 |
