Glycoside
GD125585
Name:
methyl 5-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hexanoateFormula:
C13H24O8Smiles:
COC(=O)CC(CC(C)O)C1OC(CO)C(O)C(O)C1OAglycone:
COC(=O)CCCC(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | -2.22 | Num_rotatable_bonds: | 6 |
| MolWt: | 308.33 | Num_heavy_atoms: | 21 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD50793
Formula: C7H14O3
Smiles:
COC(=O)CCCC(C)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 146.19 | Num_heavy_atoms: | 10 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
