Glycoside
GD147169
Name:
2-{[3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydro-1H-inden-1-yl]oxy}-6-methoxyoxane-3,4,5-triolFormula:
C20H30O8Smiles:
COC1OC(OC2c3c(cc(C)c(CCO)c3C)C(O)C2C)C(O)C(O)C1OAglycone:
Cc1cc2c(c(C)c1CCO)C(O)C(C)C2OSugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 398.45 | Num_heavy_atoms: | 28 |
| TPSA: | 128.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD58950
Formula: C14H20O3
Smiles:
Cc1cc2c(c(C)c1CCO)C(O)C(C)C2O| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 2 |
| MolWt: | 236.31 | Num_heavy_atoms: | 17 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
