Glycoside
GD149720
Name:
6-{[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy}-5-methoxy-9,10,16-trimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl propanoateFormula:
C32H53O10NSmiles:
CCC(=O)OC1CC(=O)OC(C)CC=CC=CC(C)C(C)CC(CC=O)C(OC2OC(C)C(O)C(N(C)C)C2O)C1OCAglycone:
CCC(=O)OC1CC(=O)OC(C)CC=CC=CC(C)C(C)CC(CC=O)C(O)C1OCSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 611.77 | Num_heavy_atoms: | 43 |
| TPSA: | 141.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD59855
Formula: C24H38O7
Smiles:
CCC(=O)OC1CC(=O)OC(C)CC=CC=CC(C)C(C)CC(CC=O)C(O)C1OC| HBA: | 7 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.71 |
| AlogP: | 3.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 438.56 | Num_heavy_atoms: | 31 |
| TPSA: | 99.13 | NumAromaticRings: | 0 |
