Glycoside
GD121471
Name:
2-({8-hydroxy-1,3,3-trimethyl-2-oxabicyclo[3.2.2]nonan-7-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C17H30O8Smiles:
CC1(C)CC2CC(O)C(C)(O1)C(OC1OC(CO)C(O)C(O)C1O)C2Aglycone:
CC1(C)CC2CC(O)C(C)(O1)C(O)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.42 | Num_heavy_atoms: | 25 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD48900
Formula: C11H20O3
Smiles:
CC1(C)CC2CC(O)C(C)(O1)C(O)C2| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 0 |
| MolWt: | 200.28 | Num_heavy_atoms: | 14 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
