Glycoside
GD015158
Name:
NoneFormula:
C15H23O9N3Smiles:
Cn1c(=O)ccn([C@@H]2O[C@H](CO[C@@H]3O[C@H](CN)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c1=OAglycone:
Cn1c(=O)cc[nH]c1=OSugarmoiety:
NCC1OC(OCC2OC(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.73 |
| AlogP: | -4.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 389.36 | Num_heavy_atoms: | 27 |
| TPSA: | 178.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD03792
Formula: C5H6O2N2
Smiles:
Cn1c(=O)cc[nH]c1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 0 |
| MolWt: | 126.11 | Num_heavy_atoms: | 9 |
| TPSA: | 54.86 | NumAromaticRings: | 1 |
