Glycoside
GD117583
Name:
27,29-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}triacontan-3-oneFormula:
C36H70O9Smiles:
CC(O)CC(O)CCCCCCCCCCCCCCCCCCCCCCCC(=O)CCOC1OC(CO)C(O)C(O)C1OAglycone:
CC(O)CC(O)CCCCCCCCCCCCCCCCCCCCCCCC(=O)CCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.97 |
| AlogP: | 5.87 | Num_rotatable_bonds: | 31 |
| MolWt: | 646.95 | Num_heavy_atoms: | 45 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD46899
Formula: C30H60O4
Smiles:
CC(O)CC(O)CCCCCCCCCCCCCCCCCCCCCCCC(=O)CCO| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.97 |
| AlogP: | 8.04 | Num_rotatable_bonds: | 28 |
| MolWt: | 484.81 | Num_heavy_atoms: | 34 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
