Glycoside
GD098842
Name:
NoneFormula:
C22H32O9N2Smiles:
CC(C)(C)OC(=O)N1CC[C@@H](Oc2cccc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2)C1Aglycone:
CC(C)(C)OC(=O)N1CCC(Oc2cccc(C(N)=O)c2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 468.5 | Num_heavy_atoms: | 33 |
| TPSA: | 158.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD42051
Formula: C16H22O4N2
Smiles:
CC(C)(C)OC(=O)N1CCC(Oc2cccc(C(N)=O)c2)C1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 306.36 | Num_heavy_atoms: | 22 |
| TPSA: | 81.86 | NumAromaticRings: | 1 |
