Glycoside
GD144037
Name:
7-({[2-(acetyloxy)-3-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoyl]oxy}methyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-yl 2-methylbut-2-enoateFormula:
C22H33O8NSmiles:
CC=C(C)C(=O)OC1CCN2CC=C(COC(=O)C(OC(C)=O)(C(C)O)C(C)(C)O)C12Aglycone:
CC=C(C)C(=O)OC1CCN2CC=C(C)C12Sugarmoiety:
CC(=O)OC(C(=O)OO)(C(C)O)C(C)(C)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 8 |
| MolWt: | 439.51 | Num_heavy_atoms: | 31 |
| TPSA: | 122.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD02135
Formula: C13H19O2N
Smiles:
CC=C(C)C(=O)OC1CCN2CC=C(C)C12| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.62 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.3 | Num_heavy_atoms: | 16 |
| TPSA: | 29.54 | NumAromaticRings: | 0 |
