Glycoside
GD114170
Name:
2-{[4-hydroxy-3-(1-hydroxyethyl)-4-methylpentyl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C14H28O8Smiles:
CC(O)C(CCOC1OC(CO)C(O)C(O)C1O)C(C)(C)OAglycone:
CC(O)C(CCO)C(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.37 | Num_heavy_atoms: | 22 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD44874
Formula: C8H18O3
Smiles:
CC(O)C(CCO)C(C)(C)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 162.23 | Num_heavy_atoms: | 11 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
