Glycoside
GD082232
Name:
NoneFormula:
C20H26O7N2Smiles:
CC1(C)C=C(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CN1C(=O)c1ccccc1Aglycone:
CC1(C)C=C(C(N)=O)CN1C(=O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 406.44 | Num_heavy_atoms: | 29 |
| TPSA: | 139.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD36926
Formula: C14H16O2N2
Smiles:
CC1(C)C=C(C(N)=O)CN1C(=O)c1ccccc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.29 | Num_heavy_atoms: | 18 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
