Glycoside
GD158057
Name:
2-[2-(1,4-dihydroxycyclohexyl)ethoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C14H26O8Smiles:
OCC1OC(OCCC2(O)CCC(O)CC2)C(O)C(O)C1OAglycone:
OCCC1(O)CCC(O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.14 | Num_rotatable_bonds: | 5 |
| MolWt: | 322.35 | Num_heavy_atoms: | 22 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD47301
Formula: C8H16O3
Smiles:
OCCC1(O)CCC(O)CC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 2 |
| MolWt: | 160.21 | Num_heavy_atoms: | 11 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
