Glycoside
GD098678
Name:
NoneFormula:
C22H33O8N3Smiles:
CC(C)(C)OC(=O)N1CCN(c2cccc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2)CC1Aglycone:
CC(C)(C)OC(=O)N1CCN(c2cccc(C(N)=O)c2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 467.52 | Num_heavy_atoms: | 33 |
| TPSA: | 152.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD41973
Formula: C16H23O3N3
Smiles:
CC(C)(C)OC(=O)N1CCN(c2cccc(C(N)=O)c2)CC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 305.38 | Num_heavy_atoms: | 22 |
| TPSA: | 75.87 | NumAromaticRings: | 1 |
