Glycoside
GD157094
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(3-ethyl-4-hydroxy-4-methylpentyl)oxy]oxane-3,4,5-triolFormula:
C19H36O11Smiles:
CCC(CCOC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)C(C)(C)OAglycone:
CCC(CCO)C(C)(C)OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.54 | Num_rotatable_bonds: | 10 |
| MolWt: | 440.49 | Num_heavy_atoms: | 30 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD58018
Formula: C8H18O2
Smiles:
CCC(CCO)C(C)(C)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 146.23 | Num_heavy_atoms: | 10 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
