Glycoside
GD076611
Name:
NoneFormula:
C17H19O7N3Smiles:
COc1ccc(C(=O)Nc2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(=O)n2)cc1Aglycone:
COc1ccc(C(=O)Nc2cc[nH]c(=O)n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 377.35 | Num_heavy_atoms: | 27 |
| TPSA: | 143.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD35285
Formula: C12H11O3N3
Smiles:
COc1ccc(C(=O)Nc2cc[nH]c(=O)n2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 3 |
| MolWt: | 245.24 | Num_heavy_atoms: | 18 |
| TPSA: | 84.08 | NumAromaticRings: | 2 |
