Glycoside
GD067678
Name:
NoneFormula:
C17H19O6N3Smiles:
Cc1ccc(C(=O)Nc2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c(=O)n2)cc1Aglycone:
Cc1ccc(C(=O)Nc2cc[nH]c(=O)n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.35 | Num_heavy_atoms: | 26 |
| TPSA: | 133.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD32220
Formula: C12H11O2N3
Smiles:
Cc1ccc(C(=O)Nc2cc[nH]c(=O)n2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 229.24 | Num_heavy_atoms: | 17 |
| TPSA: | 74.85 | NumAromaticRings: | 2 |
