Glycoside
GD142060
Name:
2-({2-[2-hydroxy-4-(hydroxymethyl)cyclohex-3-en-1-yl]propan-2-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H28O8Smiles:
CC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC(CO)=CC1OAglycone:
CC(C)(O)C1CCC(CO)=CC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.39 | Num_heavy_atoms: | 24 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD48534
Formula: C10H18O3
Smiles:
CC(C)(O)C1CCC(CO)=CC1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.25 | Num_heavy_atoms: | 13 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
