Glycoside
GD058320
Name:
NoneFormula:
C14H18O8N2Smiles:
O=C1[C@@H]2[C@@H]3C=C[C@@H](O3)[C@H]2C(=O)N1/N=C/[C@H](O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
C=NN1C(=O)C2C3C=CC(O3)C2C1=OSugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -3.65 | Num_rotatable_bonds: | 6 |
| MolWt: | 342.3 | Num_heavy_atoms: | 24 |
| TPSA: | 160.12 | NumAromaticRings: | 0 |
Unique Aglycone
AD29172
Formula: C9H8O3N2
Smiles:
C=NN1C(=O)C2C3C=CC(O3)C2C1=O| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.44 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 1 |
| MolWt: | 192.17 | Num_heavy_atoms: | 14 |
| TPSA: | 58.97 | NumAromaticRings: | 0 |
