Glycoside
GD003328
Name:
NoneFormula:
C22H31O10NSmiles:
CCOC(=O)C(C(=O)OCC)C(CC(=O)C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1cccnc1Aglycone:
CCOC(=O)C(C(=O)OCC)C(CC(C)=O)c1cccnc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 11 |
| MolWt: | 469.49 | Num_heavy_atoms: | 33 |
| TPSA: | 172.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD03032
Formula: C16H21O5N
Smiles:
CCOC(=O)C(C(=O)OCC)C(CC(C)=O)c1cccnc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 8 |
| MolWt: | 307.35 | Num_heavy_atoms: | 22 |
| TPSA: | 82.56 | NumAromaticRings: | 1 |
