Glycoside
GD147507
Name:
6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-9-fluoro-7,12-dihydroxy-4-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dioneFormula:
C36H64O12NFSmiles:
CCC1OC(=O)C(C)C(OC2CC(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)(F)C(=O)C(C)C(O)C1CAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)(F)C(=O)C(C)C(O)C1CSugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 721.9 | Num_heavy_atoms: | 50 |
| TPSA: | 173.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD50125
Formula: C29H52O9NF
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)(F)C(=O)C(C)C(O)C1C| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 577.73 | Num_heavy_atoms: | 40 |
| TPSA: | 145.99 | NumAromaticRings: | 0 |
