Glycoside
GD097405
Name:
NoneFormula:
C22H23O6N5Smiles:
Cn1c2ccccc2c2c1cc(C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)n2-c1ncccn1Aglycone:
Cn1c2ccccc2c2c1cc(C(N)=O)n2-c1ncccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 4 |
| MolWt: | 453.46 | Num_heavy_atoms: | 33 |
| TPSA: | 154.89 | NumAromaticRings: | 4 |
Unique Aglycone
AD41421
Formula: C16H13ON5
Smiles:
Cn1c2ccccc2c2c1cc(C(N)=O)n2-c1ncccn1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 291.31 | Num_heavy_atoms: | 22 |
| TPSA: | 78.73 | NumAromaticRings: | 4 |
