Glycoside
GD103253
Name:
NoneFormula:
C24H36O8N2Smiles:
Cc1cccc(C[C@]2(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)CCCN2C(=O)OC(C)(C)C)c1Aglycone:
Cc1cccc(CC2(C(N)=O)CCCN2C(=O)OC(C)(C)C)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 480.56 | Num_heavy_atoms: | 34 |
| TPSA: | 148.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD43691
Formula: C18H26O3N2
Smiles:
Cc1cccc(CC2(C(N)=O)CCCN2C(=O)OC(C)(C)C)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 2.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 318.42 | Num_heavy_atoms: | 23 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |
