Glycoside
GD140206
Name:
6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-10-(hydroxyimino)-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecan-2-oneFormula:
C36H66O13N2Smiles:
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)C(=NO)C(C)C(O)C1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=NO)C(C)C(O)C1(C)OSugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 734.93 | Num_heavy_atoms: | 51 |
| TPSA: | 209.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD14059
Formula: C29H54O10N2
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=NO)C(C)C(O)C1(C)O| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 590.76 | Num_heavy_atoms: | 41 |
| TPSA: | 181.74 | NumAromaticRings: | 0 |
