Glycoside
GD142730
Name:
2-({2-[5-ethenyl-5-(hydroxymethyl)oxolan-2-yl]propan-2-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H28O8Smiles:
C=CC1(CO)CCC(C(C)(C)OC2OC(CO)C(O)C(O)C2O)O1Aglycone:
C=CC1(CO)CCC(C(C)(C)O)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 6 |
| MolWt: | 348.39 | Num_heavy_atoms: | 24 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD57435
Formula: C10H18O3
Smiles:
C=CC1(CO)CCC(C(C)(C)O)O1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 3 |
| MolWt: | 186.25 | Num_heavy_atoms: | 13 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
