Glycoside
GD092799
Name:
NoneFormula:
C21H34O8NSmiles:
C/C=C(\C)C(=O)O[C@H]1CC[N@+]2(O)CC=C(COC(=O)[C@@](O)([C@@H](C)OC)C(C)(C)O)[C@H]12Aglycone:
CC=C(C)C(=O)OC1CC[N+]2(O)CC=C(C)C12Sugarmoiety:
COC(C)C(O)(C(=O)OO)C(C)(C)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 8 |
| MolWt: | 428.5 | Num_heavy_atoms: | 30 |
| TPSA: | 122.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD40358
Formula: C13H20O3N
Smiles:
CC=C(C)C(=O)OC1CC[N+]2(O)CC=C(C)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.31 | Num_heavy_atoms: | 17 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
