Glycoside
GD133955
Name:
6-[(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy]-2-ethyl-9-hydroxy-8-{[3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy}-1,5,7,9,11,13-hexamethyl-3,15-dioxabicyclo[10.2.1]pentadec-12-ene-4,14-dioneFormula:
C35H59O12NSmiles:
CCC1OC(=O)C(C)C(OC2CC(C)(O)C(O)C(C)O2)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2Sugarmoiety:
CC1OC(O)CC(C)(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | 2.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 685.85 | Num_heavy_atoms: | 48 |
| TPSA: | 182.47 | NumAromaticRings: | 0 |
Unique Aglycone
AD54193
Formula: C28H47O9N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 541.68 | Num_heavy_atoms: | 38 |
| TPSA: | 143.78 | NumAromaticRings: | 0 |
