Glycoside
GD127536
Name:
5-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(2,3-dihydroxypropoxy)-6-(hydroxymethyl)oxane-3,4-diolFormula:
C14H26O12Smiles:
OCC(O)COC1OC(CO)C(OC2OC(CO)C(O)C2O)C(O)C1OAglycone:
OCC(O)COSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | -5.38 | Num_rotatable_bonds: | 8 |
| MolWt: | 386.35 | Num_heavy_atoms: | 26 |
| TPSA: | 198.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD00405
Formula: C3H8O3
Smiles:
OCC(O)CO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -1.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 92.09 | Num_heavy_atoms: | 6 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
