Glycoside
GD102820
Name:
NoneFormula:
C24H36O9N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cccc(O[C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCC(Oc2cccc(C(=O)NCCO)c2)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 496.56 | Num_heavy_atoms: | 35 |
| TPSA: | 147.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD43524
Formula: C18H26O5N2
Smiles:
CC(C)(C)OC(=O)N1CCC(Oc2cccc(C(=O)NCCO)c2)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 350.42 | Num_heavy_atoms: | 25 |
| TPSA: | 88.1 | NumAromaticRings: | 1 |
