Glycoside
GD149790
Name:
6-(2-hydroxyethyl)-2-(hydroxymethyl)-2,5,7-trimethyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-2,3-dihydro-1H-inden-1-oneFormula:
C20H28O8Smiles:
Cc1cc2c(c(C)c1CCO)C(=O)C(C)(CO)C2OC1OCC(O)C(O)C1OAglycone:
Cc1cc2c(c(C)c1CCO)C(=O)C(C)(CO)C2OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 396.44 | Num_heavy_atoms: | 28 |
| TPSA: | 136.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD45954
Formula: C15H20O4
Smiles:
Cc1cc2c(c(C)c1CCO)C(=O)C(C)(CO)C2O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 264.32 | Num_heavy_atoms: | 19 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
